MonarchInit/C3PO huggingface dataset:
Compound: Acrimine B
SMILES: O=C1C=C(C(=O)C[C@]1(O)C)/C=C/C(O)(C)C
Compound: Cardinalin 11
SMILES: O=C1C2=C(O)C(C3=C(O)C=4C(=O)[C@H]5[C@@H](C[C@H](C)O[C@@H]5C)[C@H](C4C=C3OC)O)=C(OC)C=C2[C@H](O)[C@]6([C@H]1[C@H](O[C@H](C6)C)C)O
Compound: Strobilurin C
SMILES: O=C(OC)/C(/C(=C/C=C/C1=CC(OCC=C(C)C)=CC=C1)/C)=C/OC
Compound: Incarxanthone D
SMILES: O=C1C2=C(OC3=C1[C@]4(O)C(=O)N[C@H](C3)[C@H]4O)C=CC=C2O
Compound: Methyl 2-(2-formyl-3-hydroxy-5-methylphenoxy)-5-hydroxy-3-methoxybenzoate
SMILES: O=C(OC)C1=C(OC2=C(C(O)=CC(=C2)C)C=O)C(OC)=CC(=C1)O
Compound: Aphidicolin A8
SMILES: O=C1[C@@H]2[C@@]([C@]34CC[C@]([C@H](C[C@@H]3C1)C4)(O)CO)(CC[C@H]([C@]2(CO)C)O)C
Compound: Ent-4(15)-eudesmen-5,7-diol-1-one
SMILES: O=C1[C@@]2([C@@](O)(C(=C)CC1)C[C@@](O)(C(C)C)CC2)C
Compound: CC-1014
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCCC(=O)NC(CN(C)C)C)(C)C)(C)C)CC(C)C)CC(C)C)(C)C)C(O)C(C)C)CC(CC(O)CC(=O)CC)C)CC(C1)C)/C=C/C(CC)C
Compound: Incarxanthone E
SMILES: O=C1C2=C(OC(=C1[C@H](O)C(=O)OC)CCC(=O)OC)C=CC=C2O
Compound: Aphidicolin A9
SMILES: O=C1[C@]([C@@H]2C(=O)C[C@H]3C[C@@H]4C[C@@]3([C@@]2(C)CC1)CC[C@]4(O)CO)(CO)C
Compound: Muraymycin B2
SMILES: O=C1N(C=CC(N1)=O)[C@@H]2O[C@H]([C@@H](O[C@@H]3O[C@H](CN)[C@H]([C@H]3OC)O)[C@H](NCCCNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)N[C@H](C(=O)O)C(C)C)[C@H]4NC(=NCC4)N)[C@@H](OC(=O)CCCCCCC(C)C)C(C)C)C(=O)O)[C@H]([C@H]2O)O
Compound: Botryolide E
SMILES: O=C1O[C@H]([C@@H](O)C[C@H](OC(=O)C)C)C=C1
Compound: Tetrocarcin F-1
SMILES: O=[N+]([O-])[C@@]1([C@@H](NC(=O)OC)[C@H](O[C@H](C1)O[C@H]2C(=C[C@@H]3[C@]4(OC(=O)C(C4=O)=C([C@]5([C@@H](C(=CC2)C)C=C[C@H]6[C@H](O)[C@H](C)C[C@H]([C@H]56)C)C)O)CC(C=O)=C[C@H]3O)C)C)C
Compound: 2,8-dihydroxyvertixanthone
SMILES: O=C1C2=C(C(O)=CC=C2OC3=C1C(O)=CC(=C3)O)C(=O)OC
Compound: Asperophiobolin J
SMILES: O=C1[C@H]2C(=CC[C@H]3[C@@H]([C@H](/C=C\[C@H](O)C(O)(C)C)C)CC[C@@]3(C[C@@H]2[C@@](C1)(O)C)C)C=O
Compound: Notoamide N
SMILES: ClC1=C2OC(C=CC2=C3NC([C@@]4(C3=C1)C([C@@H]5C[C@@]67CCCN7C([C@@]5(C4)NC6=O)=O)(C)C)=O)(C)C
Compound: Tripropeptin D
SMILES: O=C1OC(CC(=O)NC(C(=O)N2C(C(=O)N3C(C(=O)NC(C(NC(C(NC(C(N4C(C(NC1C(O)C(=O)O)=O)C(O)CC4)=O)CO)=O)C(O)C(=O)O)=O)CCCN=C(N)N)CCC3)CCC2)C(O)C)CCCCCCCCCCC(C)C
Compound: Tetrocarcin F
SMILES: O=[N+]([O-])[C@@]1([C@H](NC(=O)OC)[C@H](O[C@H](C1)O[C@H]2C(=C[C@@H]3[C@@]4(OC(=O)C(C4=O)=C([C@]5([C@H](C(=CC2)C)C=C[C@@H]6[C@@H](O[C@@H]7O[C@@H]([C@@H](OC(=O)C)[C@H](C7)O[C@H]8O[C@@H]([C@@H](O)CC8)C)C)[C@H](C)C[C@@H]([C@H]56)C)C)O)CC(C=O)=C[C@@H]3O)C)C)C
Compound: Incarxanthone F
SMILES: O=C1C2=C(C(N[C@H]3[C@@H](O)[C@](O)(C=4C(=O)C=5C(O)=CC=CC5OC4C3)C(=O)OC)=CC=C2OC6=C1C(O)=CC=C6)C(=O)OC
Compound: Asperophiobolin K
SMILES: O=CC1=CC[C@@H]2[C@@](CC[C@@H]2[C@H](/C=C\C=C(C)C)C)(C)C[C@@]3([C@@H]1[C@H](O)C[C@H]3C)O
Compound: Wbeta2218
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H]1[C@H](CC)C)=O)[C@H](CC)C)CC2=CC=CC=C2)[C@H](CC)C
Compound: CB-182363
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)CCCCCCC(CC)C)CC=2C3=C(C=CC=C3)NC2)CCC(=O)O)CC(=O)N)C(=O)N(CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](CCCCN)C(N[C@H](C(NCC(N[C@@H](C(NC(C(N[C@H]1C(CC)C)=O)C(CC(=O)O)C)=O)CC(=O)N)=O)=O)C(OC)C(=O)O)=O)CC(=O)O)C)C)C
Compound: Tetrocarcin E2
SMILES: O=[N+]([O-])[C@@]1([C@@H](NC(=O)OC)[C@H](O[C@H](C1)O[C@@H]2C(=C[C@H]3C4(OC(=O)C(C4=O)=C([C@@]5([C@H](C(C=C2)C)C=C[C@@H]6[C@@H](O[C@@H]7O[C@H]([C@H](O)[C@@H](C7)OC(=O)C)C)[C@@H](C)C[C@@H]([C@@H]56)C)C)O)CC(C=O)=C[C@@H]3O)C)C)C
Compound: Gephysulfuromycin
SMILES: S1[C@]23C(=O)C4=C(C(O)=CC=C4)C(=C2C(=O)C[C@]5([C@]3(O)C(=O)C[C@@]1(C5)CC)O)O
Compound: Asperophiobolin A
SMILES: O=C1N[C@]2(OC)C[C@](O)(C)[C@@H]3[C@@H]2C1=CC=C4[C@@](CC[C@@H]4[C@H](/C=C\C=C(C)C)C)(C)C3
Compound: Maridomycin V
SMILES: O=C1OC(CC2OC2C=CC(O)C(CC(C(C(C(C1)OC(=O)CC)OC)OC3OC(C(OC4OC(C(OC(=O)C)C(C4)(O)C)C)C(C3O)N(C)C)C)CC=O)C)C
Compound: 3-[(3S,6S,9S,12S,15S,18S,21S,25R)-9-(carboxymethyl)-12-methyl-3,6,15,18-tetrakis(2-methylpropyl)-2,5,8,11,14,17,20,23-octaoxo-25-tridecyl-1-oxa-4,7,10,13,16,19,22-heptazacyclopentacos-21-yl]propanoic acid
SMILES: O=C1O[C@@H](CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H]1CC(C)C)=O)CC(C)C)=O)CC(=O)O)=O)C)=O)CC(C)C)CCC(=O)O)CCCCCCCCCCCCC
Compound: Tetrocarcin E1
SMILES: O=[N+]([O-])[C@@]1([C@@H](NC(=O)OC)[C@H](O[C@H](C1)O[C@@H]2C(=C[C@H]3C4(OC(=O)C(C4=O)=C([C@@]5([C@H](C(=CC2)C)C=C[C@@H]6C(O[C@@H]7O[C@H]([C@H](OC(=O)C)[C@@H](C7)O)C)[C@@H](C)C[C@@H]([C@@H]56)C)C)O)CC(C=O)=C[C@@H]3O)C)C)C
Compound: Homophenanthroviridone
SMILES: O=C1C=2N=CC3=CC(CC)=CC(=C3C2C(=O)C=4C1=C(O)C=CC4)O
Compound: Asperophiobolin B
SMILES: O=C1N[C@]2(O)C[C@](O)(C)[C@@H]3[C@@H]2C1=CC=C4[C@@](CC[C@@H]4[C@H](/C=C\C=C(C)C)C)(C)C3
Compound: Pyrrolam B
SMILES: O=C1N2[C@](OC)(CCC2)CC1
Compound: Blennolide C
SMILES: O=C1C2=C(O)C3=C(C=C(C)C=C3O)O[C@@]2(C(=O)OC)[C@@H](O)CC1
Compound: 5-methyl-1H-quinazoline-2,4-dione
SMILES: O=C1NC(=O)C=2C(=CC=CC2N1)C
Compound: Asperophiobolin C
SMILES: O=C1N[C@@H]2C[C@](O)(C)[C@@H]3[C@@H]2C1=CC=C4[C@@](CC[C@@H]4[C@H](/C=C\C=C(C)C)C)(C)C3
Compound: Homobenzo[b]phenanthridonamide
SMILES: O=C1NC=2C(=O)C3=C(O)C=CC=C3C(C2C4=C1C=C(CC)C=C4O)=O
Compound: Paulomycin B
SMILES: S=C=N/C(/C(=O)O[C@H]1[C@@H](O[C@H]2O[C@@H]([C@](O)([C@@H](OC(=O)C(C)C)C)[C@@H](C2)OC)C)[C@@H](O)[C@H]([C@]3(O)C(O)=C(C(=N)C(C3)=O)C(=O)O)O[C@@H]1COC(=O)C)=C\C
Compound: Bergofungin D
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(CO)CC2=CC=CC=C2)(C)C)CC(C1)O)C(NC(=O)C(NC(=O)C3N(C(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C)C(C)C)(C)C)(C)C)C(C)C)CC(C)C)(C)C)(C)C)CC(C3)O)CCC(=O)N)(CC)C
Compound: Trichurusin K
SMILES: O=C1O[C@@H]([C@H](OC(=O)/C=C/C(=C/[C@@H](COC(=O)C)CCO)/C)C=C1)[C@H](C[C@H](C/C(=C/C)/C)C)C
Compound: Homostealthin D
SMILES: O=C1C2=C(O)C=CC=C2C(=O)[C@@]3(C1=C(N)C=4C=C(CC)C=C(C34)O)CC(=O)C
Compound: Asperophiobolin D
SMILES: O=C1N[C@]2(OC)C[C@](O)(C)[C@@H]3[C@@H]2C1=CC[C@@H]4[C@@](CC[C@@H]4[C@H](/C=C\C=C(C)C)C)(C)C3
Compound: Paulomycin A
SMILES: S=C=N/C(/C(=O)O[C@H]1[C@@H](O[C@@H]2O[C@H]([C@](O)([C@H](OC(=O)[C@H](CC)C)C)[C@H](C2)OC)C)[C@@H](O)[C@H]([C@]3(O)C(O)=C(C(=N)C(C3)=O)C(=O)O)O[C@@H]1COC(=O)C)=C/C
Compound: Fumiquinazoline N
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@@](O)(N(C)C([C@H]2C[C@@]4(O)C5=C(C=CC=C5)N6[C@@H]4N(C(=O)C)C7(CC7)C6=O)=O)C
Compound: Nenesfuran
SMILES: O=C1C2=C(O)C=CC=C2C(=O)C3=C1OC=4C=C(CC)C=C(C34)C(=O)O
Compound: Nitrosporeunol B
SMILES: O=C(O)CC/C=C/C1=C(C=CC=C1)CO
Compound: Asperophiobolin E
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(C(=O)O)=CC[C@H]3[C@@H]([C@H](/C=C\C=C(C)C)C)CC[C@@]3(C2)C
Compound: 4-hydroxyphenyl 6-deoxy-alpha-L-talopyranoside
SMILES: O1[C@@H](OC2=CC=C(O)C=C2)[C@H](O)[C@H](O)[C@@H]([C@@H]1C)O
Compound: 4-O-demethyl-11-deoxydoxorubicin
SMILES: O=C1C2=C(O)C3=C(C[C@@](O)(C(=O)CO)C[C@H]3O[C@@H]4O[C@@H]([C@H](O)[C@@H](C4)N)C)C=C2C(=O)C=5C1=C(O)C=CC5
Compound: Nenesophanol
SMILES: O=C1C2=C(C(=O)C=3C1=C(O)C=CC3)C(=C(CC)C=C2O)C(=O)C
Compound: Lactapiperanol B
SMILES: O=C(O[C@@H]1[C@]2(O)[C@]3([C@@](C)([C@@H]4[C@H]1CC(C)(C)C4)C3)[C@@H](OC)OC2)C
Compound: Sorrentanone
SMILES: O=C1C(=O)C(=C(C(=O)/C=C/C=C/C)C(=C1C)O)C
Compound: Asperophiobolin F
SMILES: O=C1C=C(C)[C@@H]2[C@H]1C(=CC[C@H]3[C@@H]([C@H](/C=C\[C@@H](O)C(O)(C)C)C)CC[C@@]3(C2)C)C=O
Compound: 4-O-demethyl-11-deoxydaunorubicin
SMILES: O=C1C2=C(O)C3=C(C[C@@](O)(C(=O)C)C[C@H]3O[C@@H]4O[C@@H]([C@H](O)[C@@H](C4)N)C)C=C2C(=O)C=5C1=C(O)C=CC5
Compound: WS-5995-D
SMILES: O=C1C(=O)C2=C(O)C=CC=C2C(=C1C3=C(O)C=C(CC)C=C3C(=O)OC)O
Compound: 12alpha-Hydroxy-3-ketocholanic acid
SMILES: O=C1CC2[C@](C3C(C4[C@](C([C@@H](CCC(=O)O)C)CC4)(C)[C@H](C3)O)CC2)(C)CC1
Compound: 18-deoxyleucopaxillone A
SMILES: O=C1C(C2=CC[C@H]3[C@]4([C@]([C@@H]([C@@H]([C@H](OC(=O)C)C[C@@H](OC(=O)C)C(O)(C)C)C)CC4)(C)CC[C@]3([C@@H]2CC1)C)C)(C)C
Compound: Asperophiobolin G
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(=CC[C@H]3[C@@H]([C@H](/C=C\[C@@H](O)C(O)(C)C)C)CC[C@@]3(C2)C)C=O
Compound: WS-1228 B
SMILES: O=NN/N=C/C=C/C=C/C=C/CCCC
Compound: Androsamide
SMILES: S(CC[C@@H]1N(C(=O)[C@@H](NC(=O)[C@H]([C@H](O)C)NC([C@@H](N(C1=O)C)CC=2C3=C(OC)C=CC=C3NC2)=O)[C@H](CC)C)C)C
Compound: Monankarin F
SMILES: O=C1OC2=C(C(=C(C)C(=C2C)O)CC(O)C)C=C1C=3OC(CC(C3)=O)C
Compound: Roseopurpurin H
SMILES: O=C1O[C@H](CCC[C@H]([C@]2(C(=O)[C@H](OC3=C(C(O)=CC(=C3)C)C)[C@](OC)(C)[C@@H](C2=O)O)C)CC(C4=C(C1)C=C(O)C=C4O)=O)C
Compound: 7,8-dihydromethanopterin
SMILES: C[C@@H](Nc1ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]2O[C@H](COP(O)(=O)O[C@@H](CCC(O)=O)C(O)=O)[C@@H](O)[C@H]2O)cc1)C1=Nc2c(N[C@H]1C)nc(N)[nH]c2=O
Compound: Asperophiobolin H
SMILES: O=C1C=C(C)[C@@H]2[C@H]1C(=CC[C@H]3[C@@H]([C@H](/C=C\[C@H](O)C(O)(C)C)C)CC[C@@]3(C2)C)C=O
Compound: Oligostatin E
SMILES: O=C[C@H](O)[C@@H](O)[C@@H](O[C@H]1O[C@H]([C@@H](O[C@H]2O[C@H]([C@@H](O[C@H]3O[C@H]([C@@H](O[C@H]4O[C@H]([C@H](N[C@H]5[C@H](O)[C@@H](O)[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@@H]([C@H]6O)O)CO)[C@@H]([C@H]5O)CO)[C@@H]([C@@H]4O)O)C)[C@@H]([C@H]3O)O)CO)[C@@H]([C@@H]2O)O)CO)[C@@H]([C@H]1O)O)CO)[C@H](O)CO
Compound: (2S)-2-[[(1S)-1-[(6S)-2-amino-1,4,5,6-tetrahydropyrimidin-6-yl]-2-[[(2S)-1-[[(2S)-1-(4-hydroxyphenyl)-3-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]carbamoylamino]-3-(4-hydroxyphenyl)propanoic acid
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)C)CC1=CC=C(O)C=C1)C(C)C)[C@H]2NC(=NCC2)N)N[C@H](C(=O)O)CC3=CC=C(O)C=C3
Compound: Cristatumin B
SMILES: O=C1N[C@H](C(=O)N[C@H]1CO)CC=2C3=C(C(=CC(=C3)CC=C(C)C)CC=C(C)C)NC2C(C=C)(C)C
Compound: Lyngbyacyclamide B
SMILES: O=C1N([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](C(N[C@H]1CCC(=O)N)=O)CC(C)C)=O)CCO)=O)[C@H](O)C(C)C)=O)C(C)C)=O)CCCCCCC)[C@H](O)C)CC3=CC=CC=C3)C[C@H](C2)O)[C@H](O)C)[C@H](O)C(=O)N)[C@H](CC)C)C
Compound: Oligostatin D
SMILES: O=C[C@H](O)[C@H](O)[C@H](O[C@H]1O[C@H]([C@@H](O[C@H]2O[C@H]([C@@H](O[C@H]3O[C@@H]([C@@H](O[C@H]4O[C@@H]([C@@H](N[C@@H]5[C@H](O)[C@@H](O)[C@H](O)[C@H]([C@H]5O)CO)[C@@H]([C@H]4O)O)C)[C@@H]([C@H]3O)O)CO)[C@@H]([C@@H]2O)O)CO)[C@@H]([C@H]1O)O)CO)[C@H](O)CO
Compound: Asperophiobolin I
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(=CC[C@H]3[C@@H]([C@H](/C=C\[C@@H]4OC4(C)C)C)CC[C@@]3(C2)C)C=O
Compound: Napyradiomycin A
SMILES: Cl[C@@H]1C=C2C(=O)C3=C(O)C4=C(O)C=C3C([C@]2(CC=C(CC=C(C4)CO)C)OC1(C)C)=O
Compound: (2S)-2-[[(1S)-1-[(6S)-2-amino-1,4,5,6-tetrahydropyrimidin-6-yl]-2-[[(2S)-3-methyl-1-oxo-1-[[(2S)-3-oxo-1-phenylbutan-2-yl]amino]butan-2-yl]amino]-2-oxoethyl]carbamoylamino]-3-(4-hydroxyphenyl)propanoic acid
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)C)CC1=CC=CC=C1)C(C)C)[C@H]2NC(=NCC2)N)N[C@H](C(=O)O)CC3=CC=C(O)C=C3
Compound: Marqualide
SMILES: O=C1O[C@H](C)C(=C1C(C=2C(=O)O[C@@H](C2O)C)CC[C@@H](O)CC)O
Compound: Oligostatin C
SMILES: O=CC(O)C(O)C(OC1OC(C(OC2OC(C(OC3OC(C(NC4C(O)C(O)C(O)C(C4O)CO)C(C3O)O)C)C(C2O)O)CO)C(C1O)O)CO)C(O)CO
Compound: (2'R,3'S)-[(2E,4E)-2-methyl-hexa-2,4-dienoic acid-allo-isoleucinaldehyde]
SMILES: O=C(N[C@@H](C=O)[C@H](CC)C)/C(=C/C=C/C)/C
Compound: [(3R,6S)-6-hydroxy-12-methyl-2,5-dioxo-oxacyclododec-3-yl] 4,11-dihydroxydodec-2-enoate
SMILES: O=C1OC(CCCCC[C@@H](C(C[C@H]1OC(=O)C=CC(O)CCCCCCC(O)C)=O)O)C
Compound: (2S)-2-[[(1S)-1-[(6S)-2-amino-1,4,5,6-tetrahydropyrimidin-6-yl]-2-[[(2S)-1-[[(2S)-1-(4-hydroxyphenyl)-3-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]carbamoylamino]-3-phenylpropanoic acid
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)C)CC1=CC=C(O)C=C1)C(C)C)[C@H]2NC(=NCC2)N)N[C@H](C(=O)O)CC3=CC=CC=C3
Compound: 28-dehydroxymethyl-28,30-dihydroxyrifamycin W
SMILES: O=C1NC=2C(=O)C3=C(O)C(=C(O)C(=C3C(C2)=O)C(=O)C(=C[C@@H](O)[C@H](O)[C@@H]([C@H]([C@H]([C@H]([C@@H]([C@H]([C@H](C=CC=C1CO)C)O)C)O)C)O)C)C)C
Compound: (+/-)-peniphenone E
SMILES: O=C1O[C@@H](CC(=O)O)C(=C1CC2=C(O)C(C(=O)C)=CC(=C2O)C)O
Compound: Tsugicoline C
SMILES: O[C@@H]1C(=C2[C@@]([C@H](O)[C@@H]2O)(C)[C@@H]3[C@H]1CC(C)(C)C3)CO
Compound: Cylindrocyclophane C3
SMILES: ClC(Cl)CCC[C@@H]1C2=C(O)C=C(C[C@H](CCCC[C@H](CCCCCl)C3=C(C=C([C@@H]([C@H](CCCC1)C)O)C=C3O)O)C)C=C2O
Compound: 6'-epi-paecilosetin A
SMILES: O=C1N[C@]([C@H](O)C)(C)C(C1=C(O)[C@@]2([C@@H](C=C[C@H]3[C@H]2CC[C@H](C3)C)C=CC)C)=O
Compound: 16,17-dehydrorifamycin G
SMILES: O=C1NC=2OC3=C(O)C(=C4O[C@@](C(C4=C3C(C2)=O)=O)(OC=C[C@H](OC)[C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](C=CC=C1C)C)O)C)O)C)OC(=O)C)C)C)C
Compound: Aflaquinolone I
SMILES: O=C1NC2=C(C=CC=C2)[C@]([C@H]1O)(O)C3=CC(O)=CC=C3
Compound: Paecilosetin B
SMILES: O=C1N[C@]([C@@H](O)C)(C)C(C1=C(O)[C@@]2([C@@H](C=C[C@H]3[C@H]2CC[C@H](C3)CO)C=CC)C)=O
Compound: Dihydrotrichodimerol
SMILES: O=C1C(=C(O)/C=C/C=C/C)C2[C@@]3(O[C@@]4([C@]2(C(O)=C(C5[C@]1([C@]3(O[C@@]54C)O)C)C(=O)CC/C=C/C)C)O)C
Compound: Xestostreptin
SMILES: O=C1N([C@H](C(=O)NC1=C)[C@@H](OC)C)C
Compound: Arisugacin P
SMILES: O=C1OC(C2=CC=C(OC)C=C2)=CC3=C1C[C@@H]4[C@]5(C=CC(=O)C([C@@H]5CC[C@]4(O3)C)(C)C)C
Compound: 3,31-dihydroxyrifamycin S
SMILES: O=C1NC2=C(O)C3=C(O)C(=C4O[C@@](C(C4=C3C(C2=O)=O)=O)(OC=C[C@H](OC)[C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](C=CC=C1C)CO)O)C)O)C)OC(=O)C)C)C)C
Compound: 6'-epi-paecilosetin B
SMILES: O=C1N[C@]([C@H](O)C)(C)C(C1=C(O)[C@@]2([C@@H](C=C[C@H]3[C@H]2CC[C@H](C3)CO)C=CC)C)=O
Compound: Boletinin H
SMILES: O=C(O)/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COC(=O)/C=C/C(=O)O)/C)/C)/C)/C
Compound: Armochaetoglobin D
SMILES: O=C1N[C@@H](CC=2C3=C(C=CC=C3)NC2)[C@H]4[C@]1(C(=O)CCC(=O)O)[C@@H](/C=C/CC(/C=C(/C=O)\C)C)[C@@H]5O[C@]5(C)[C@H]4C
Compound: 3-hydroxyrifamycin S
SMILES: O=C1NC2=C(O)C3=C(O)C(=C4O[C@@](C(C4=C3C(C2=O)=O)=O)(OC=C[C@H](OC)[C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]([C@H](C=CC=C1C)C)O)C)O)C)OC(=O)C)C)C)C
Compound: Arisugacin Q
SMILES: O=C1OC(C2=CC=C(OC)C=C2)=CC(=C1C/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)O
Compound: Paecilosetin C
SMILES: O=C1N/C(=C\C)/C(=C1C(=O)[C@@]2([C@@H](C=C[C@H]3[C@H]2CC[C@H](C3)C)C=CC)C)O
Compound: Anabaenopeptin MM823
SMILES: O=C1N([C@H](C(=O)N[C@H](C(=O)NCCCC[C@H](C(N[C@H](C(N[C@H]1CCC2=CC=C(O)C=C2)=O)C(C)C)=O)NC(=O)N[C@H](C(=O)O)CCC(=O)OC)CC3=CC=CC=C3)C)C
Compound: Rifamycin W-lactone
SMILES: O=C1NC=2C(=O)C3=C(O)C(=C(O)C(=C3C(C2)=O)C(=O)C(=C[C@@H](C=O)[C@H](O)[C@@H]([C@H]([C@H]([C@H]([C@@H]([C@H]([C@H](C=CC=C1CO)C)O)C)O)C)O)C)C)C
Compound: Arisugacin L
SMILES: O=C1OC(C2=CC=C(OC)C=C2)=CC3=C1C[C@]4(O)[C@@]5([C@](O)(C([C@H](O)C[C@H]5O)(C)C)CC[C@]4(O3)C)C
Compound: 4-Desmethyl-9-keto-epothilone D, diaster
SMILES: S1C(=NC(=C1)/C=C(/C2OC(=O)C[C@H](O)C(C(=O)[C@@H]([C@@H](O)[C@H](C(CCC(=CC2)C)=O)C)C)C)\C)C
Compound: Sarcosone B
SMILES: O=C1C=C(OC)[C@H](O)[C@@H]2[C@]1(O2)C/C=C(/CO)\C
Compound: Paecilosetin D
SMILES: O=C1NC(=CC)C(=C1C(=O)[C@@]2([C@@H](C=C[C@H]3[C@H]2CC[C@H](C3)CO)C=CC)C)O
Compound: 30-hydroxyrifamycin W
SMILES: O=C1NC=2C(=O)C3=C(O)C(=C(O)C(=C3C(C2)=O)C(=O)C(=C[C@H]([C@H](O)[C@@H]([C@H]([C@H]([C@H]([C@@H]([C@H]([C@H](C=CC=C1CO)C)O)C)O)C)O)C)CO)C)C
Compound: Arisugacin M
SMILES: O=C1OC(C2=CC=C(OC)C=C2)=CC3=C1C[C@]4(O)[C@@]5([C@](O)(C([C@@H](O)CC5)(C)C)CC[C@]4(O3)C)C
Compound: Deflectin 1a
SMILES: O=C1C=C2C(=COC(=C2)C)C=3[C@@]1(OC(=O)C3C(=O)CCCCCCC)C
Compound: Trichokonin V
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CO)CC2=CC=CC=C2)CCC(=O)N)CCC(=O)N)(C)C)(C)C)C(C)C)CCC1)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C)(C)C)C)(C)C)C)(C)C)CCC(=O)N)(C)C)C(C)C)(C)C)CC(C)C)(C)C
Compound: Tolypyridone C
SMILES: O=C1NC=C(C2=CC=C(O)C=C2)C(=C1C(=O)[C@H](C[C@H](C/C=C/C)C)C)O
Compound: Carpetimycin B
SMILES: S(=O)(=O)(OC([C@@H]1C(=O)N2C(C(=O)O)=C(C[C@H]12)S(=O)/C=C/NC(=O)C)(C)C)O
Compound: Arisugacin N
SMILES: O=C1OC(C2=CC=C(OC)C=C2)=CC3=C1C[C@]4(O)[C@@]5([C@](O)(C(C(=O)C[C@H]5O)(C)C)CC[C@]4(O3)C)C
Compound: 24-Demethyl-bafilomycin A2
SMILES: O=C1O[C@@H]([C@@H](OC)C=CC=C(C[C@@H]([C@@H]([C@@H](C=C(C=C1OC)C)C)O)C)C)[C@H]([C@@H](O)[C@@H]([C@@]2(O[C@@H]([C@@H](C)[C@@H](C2)O)CC)OC)C)C
Compound: Tolypyridone D
SMILES: O=C1NC=CC(=C1C(=O)[C@H](C[C@H](C/C=C/C)C)C)O
Compound: Cymobarbatol
SMILES: BrC1=C(O)C=C2C[C@H]3C([C@@H](Br)CC[C@]3(OC2=C1)C)(C)C
Compound: Carpetimycin A
SMILES: S(=O)(C1=C(N2C(=O)[C@H]([C@H]2C1)C(O)(C)C)C(=O)O)/C=C/NC(=O)C
Compound: Arisugacin O
SMILES: O=C1OC(C2=CC=C(OC)C=C2)=CC3=C1C[C@]4(O)[C@]5(C(=O)C[C@@H](O)C([C@]5(O)CC[C@]4(O3)C)(C)C)C
Compound: Mabetaarigenin A
SMILES: O=C1OC(=C)[C@@H]([C@@]12[C@H](O)[C@H](O)C=C[C@@H]2C)O
Compound: Tetrocarcin B
SMILES: O=[N+]([O-])[C@@]1([C@@H](NC(=O)OC)[C@H](O[C@H](C1)O[C@@H]2C(=C[C@H]3C4(OC(=O)C(C4=O)=C([C@@]5([C@H](C(=CC2)C)C=C[C@@H]6C(O[C@@H]7O[C@H]([C@H](OC(=O)C)[C@@H](C7)OC8COC(C)C(C8)OC9OC(C(O)C(C9)O)C)C)[C@@H](C)C[C@@H]([C@@H]56)C)C)O)CC(C=O)=C[C@@H]3O)C)C)C
Compound: Fumiquinazoline O
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@@](OC)(N(C)C([C@H]2C[C@@]4(O)C5=C(C=CC=C5)N6[C@@H]4N(C(=O)C)C7(CC7)C6=O)=O)C
Compound: Tolypyridone E
SMILES: O=C1N=CC(C2=CC=C(O)C=C2)=C3C1[C@H](O)[C@](C[C@H](C/C=C/C)C)(C)O3
Compound: Seco-Chaetomugilin D
SMILES: ClC1=C2C(=COC(=C2)/C=C/[C@H](CC)C)[C@@H]3[C@@H](C(=O)OC)[C@@](O[C@@]3(C1=O)C)(O)[C@@H]([C@H](O)C)C
Compound: Gibbosic acid J
SMILES: O=C1C2=C([C@]3(CCC(C([C@@H]3C1)(C)C)=O)C)[C@@H](O)[C@H](O)[C@]4([C@]2([C@H](O)C[C@@H]4/C(=C/C(=O)C[C@@H](C(=O)O)C)/C)C)C
Compound: 7beta,8,beta2,'3'-diepoxyroridin H
SMILES: O=C1O[C@H]2C3([C@@]4([C@@H](C=C(C)C5[C@H]4O5)OC(C2)[C@]36OC6)COC(=O)C7OC7(C)CC8OC(C=CC=C1)C(O8)C)C
Compound: Fumigatin chlorohydrin
SMILES: ClC1C(=O)C(OC)=C(O)C(C1(O)C)=O
Compound: Anti-13,15-dihydroxypretenellin B
SMILES: O=C1NC=C(C2=CC=C(O)C=C2)C(=C1C(=O)/C=C/C(=C/[C@@H]([C@H](O)C)CO)/C)O
Compound: Tolypyridone F
SMILES: O=C1N=CC(C2=CC=C(O)C=C2)=C3C1[C@@H](O)[C@](C[C@H](C/C=C/C)C)(C)O3
Compound: Gibbosic acid K
SMILES: O=C1C2=C([C@]3(CCC(C([C@@H]3C1)(C)C)=O)C)C[C@H](O)[C@]4([C@]2([C@H](O)C[C@@H]4/C(=C/C(=O)C[C@@H](C(=O)O)C)/C)C)C
Compound: 7beta,8beta-epoxyroridin H
SMILES: O=C1OC[C@@]23C4([C@@]5(OC5)C(O[C@@H]2C=C(C)C6[C@H]3O6)C[C@H]4OC(=O)C=CC=CC7OC(CC(=C1)C)OC7C)C
Compound: Ro09-1545
SMILES: O=C(OC1C(OCC(C1OC)C)/C(=C/C=C/C=C/CCC)/C)CNCCC(=O)C
Compound: Tolypyridone G
SMILES: O=C1N=CC(C2=CC=C(O)C=C2)=C3C1[C@@H](O)[C@@](C[C@H](C/C=C/C)C)(C)O3
Compound: Torulosic acid
SMILES: O=C1C(C2[C@](C3=C([C@]4([C@]([C@@H](C(C(=O)O)C)CC4)(C)CC3)C)CC2)(C)CC1)(C)C
Compound: Gibbosic acid L
SMILES: O=C1C2=C(C=C[C@]3([C@]2([C@@H](O)C[C@@H]3/C(=C/C(=O)C[C@@H](C(=O)O)C)/C)C)C)[C@]4(CCC(C([C@@H]4C1)(C)C)=O)C
Compound: (1S)-(4-Acetylphenyl)-1,2-ethanediol
SMILES: O=C(C1=CC=C([C@H](O)CO)C=C1)C
Compound: 7beta,8beta-epoxyisororidin E
SMILES: O=C1OC[C@@]23C4([C@@]5(OC5)C(O[C@@H]2C=C(C)C6[C@H]3O6)C[C@H]4OC(=O)C=CC=CC(OCCC(=C1)C)C(O)C)C
Compound: Tolypyridone H
SMILES: O=C1N=CC(C2=CC=C(O)C=C2)=C3C1[C@H](O)[C@@](C[C@H](C/C=C/C)C)(C)O3
Compound: Aspilactonol D
SMILES: O=C1O[C@@H]([C@@H](O)C)C=C1[C@H](OC)[C@H](O)C
Compound: Tigloylpyrrothine
SMILES: S1SC=C2C1=C(NC(=O)/C(=C/C)/C)C(=O)N2C
Compound: Isororidin E
SMILES: O=C1OC[C@@]23C4([C@@]5(OC5)C(O[C@@H]2C=C(C)CC3)C[C@H]4OC(=O)C=CC=CC(OCCC(=C1)C)C(O)C)C
Compound: Gibbosic acid M
SMILES: O=C1C2=C(C=C[C@]3([C@]2([C@H](O)C[C@@H]3/C(=C/C(=O)C[C@@H](C(=O)O)C)/C)C)C)[C@]4(CCC(C([C@@H]4C1)(C)C)=O)C
Compound: 20beta-carboxylconidiogenone C
SMILES: O=C1C=C[C@H](C)[C@]23[C@]1(CC[C@H]2[C@@H]4[C@@](C(=O)O)(CC[C@@]4(C3)C)C)C
Compound: Gageopeptide B
SMILES: O=C(O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](O)CCCCCCCCC(CC)C)CCC(=O)OC)CC(C)C)CC(C)C)CC(C)C
Compound: Pestalotiopamide C
SMILES: O=C(NCCCC(=O)OC)/C=C(/CCOC(=O)C)\C
Compound: Roridin H
SMILES: O=C1OC[C@@]23C4([C@@]5(OC5)C(O[C@@H]2C=C(C)CC3)C[C@H]4OC(=O)C=CC=CC6OC(CC(=C1)C)OC6C)C
Compound: Gibbosic acid N
SMILES: O=C1C=C2[C@@]3([C@H](C(C(=O)CC3)(C)C)C[C@H]4[C@@]2(O4)[C@]5([C@]1([C@@H](/C(=C/C(=O)C[C@@H](C(=O)O)C)/C)C[C@@H]5O)C)C)C
Compound: 20beta-carboxylconidiogenone K
SMILES: O=C1[C@]2([C@@]3([C@@H](C)[C@H]4[C@@H]1O4)[C@H]([C@@H]5[C@@](C(=O)O)(CC[C@@]5(C3)C)C)CC2)C
Compound: Plusbacin A3
SMILES: O=C1OC(CC(=O)N[C@@H](C(=O)N[C@@H](C(=O)N2[C@H](C(=O)N[C@H](C(N[C@@H](C(N[C@@H](C(N3[C@H](C(N[C@H]1[C@H](O)C(=O)O)=O)[C@H](O)CC3)=O)CO)=O)[C@@H](O)C(=O)O)=O)CCCN=C(N)N)[C@H](O)CC2)C)[C@H](O)C)CCCCCCCCCCC(C)C
Compound: Expansolide B
SMILES: O=C1O[C@@]2(OC[C@@]3(C2)C4C(=C)[C@H](OC(=O)C)C[C@@H]3C4)C[C@H]1C
Compound: Gibbosic acid O
SMILES: O=C1C=C2C(=CC[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@]4([C@]1([C@@H](/C(=C/C(=O)C[C@@H](C(=O)O)C)/C)C[C@@H]4O)C)C
Compound: Termitomycamide E
SMILES: O=C(NCCC1=CC=C(O)C=C1)CCCCCCC/C=C\C/C=C\CCCCC
Compound: 19alpha-hydroxyconidiogenone C
SMILES: O=C1C=C[C@H](C)[C@]23[C@]1(CC[C@H]2[C@@H]4C(CC[C@@]4(C3)C)(CO)CO)C
Compound: Quinoline-2-methanol acetate
SMILES: O=C(OCC1=NC=2C(=CC=CC2)C=C1)C
Compound: Penarine E
SMILES: O=C(O)[C@@]1(C[C@@]23[C@@H](C[C@@H]([C@H]2C1)C(=O)O)CC[C@H]3C)C
Compound: Hamigerone
SMILES: O=C1C(C2C(=CC(C)=C(C2/C=C(/C3OC3(/C=C/C(=O)O)C)\C)CC(=O)C)CC1C)C
Compound: 7alpha-hydroxyconidiogenone C
SMILES: O=C1C=C[C@H](C)[C@]23[C@]1(C[C@H](O)[C@H]2[C@@H]4[C@](CC[C@@]4(C3)C)(CO)C)C
Compound: Gibbosicolid A
SMILES: O=C1C=C2[C@@]3([C@H](C(C(=O)CC3)(C)C)C[C@@H]4[C@]2(O4)[C@]5([C@]1([C@@H](/C(=C/[C@H]6OC(=O)[C@H](C6)C)/C)C[C@@H]5O)C)C)C
Compound: Quinoline-2-methanol
SMILES: OCC1=NC=2C(=CC=CC2)C=C1
Compound: CJ-16,196
SMILES: O=C1NC=C(C2=CC=CC=C2)C3=C1[C@](/C=C(/C(O)C)\C)([C@H](O)O3)C
Compound: Epicoccin P
SMILES: S1[C@@]23N(C(=O)[C@]4(SC)C[C@H]5[C@H](N4C2=O)[C@@H](O)CC[C@@H]5O)[C@H]6[C@@H](C3)C([C@@H]1C[C@@H]6O)=O
Compound: 8beta-hydroxyconidiogenone C
SMILES: O=C1C=C[C@H](C)[C@]23[C@]1([C@@H](O)C[C@H]2[C@@H]4[C@](CC[C@@]4(C3)C)(CO)C)C
Compound: Gibbosicolid B
SMILES: O=C1C=C2[C@@]3([C@H](C(C(=O)CC3)(C)C)C[C@@H]4[C@]2(O4)[C@]5([C@]1([C@@H](/C(=C/[C@@H]6OC(=O)[C@H](C6)C)/C)C[C@@H]5O)C)C)C
Compound: Cerexin B
SMILES: O=C(O)[C@H](NC(=O)[C@H](NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)CCCCCCCCCCCCC)CC(=O)N)C(C)C)CC1=CC=CC=C1)CC(=O)N)CC(=O)N)C[C@@H](O)CCN)[C@H](O)C)CC=2C3=C(C=CC=C3)NC2)[C@H](CC)C
Compound: Semiplenamide C
SMILES: O=C(N[C@H](CO)C)/C(=C/CCCCCCCCCCCCC)/C
Compound: Gibbosicolid C
SMILES: O=C1C=C2[C@@]3([C@H](C(C(=O)CC3)(C)C)C[C@@H]4[C@]2(O4)[C@]5([C@]1([C@@H](C(=C[C@H]6OC(=O)[C@H](C6)C)C)C[C@H]5O)C)C)C
Compound: [(1aR,6aR,7S,7aR)-3,3,6a,7a-tetramethyl-2-oxo-1a,2a,4,5,6,7-hexahydronaphtho[2,3-b]oxiren-7-yl]methyl octadec-9-enoate
SMILES: O=C1C2[C@@]([C@@H](COC(=O)CCCCCCCC=CCCCCCCCC)[C@@]3([C@H]1O3)C)(CCCC2(C)C)C
Compound: Ganoweberianic acid A
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@@]4([C@H](O)C[C@@H]([C@]4(C1)C)[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C
Compound: Rhizoctonic acid
SMILES: O=C(O)C1=C(C(OC)=CC(=C1)O)C(=O)C2=C(OC)C=C(C)C=C2O
Compound: Cerexin A
SMILES: O=C(O)[C@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](O)CCCCCC(C)C)CC(=O)N)C(C)C)C(C)C)CC(=O)N)CC(=O)N)C[C@H](O)CCN)[C@@H](O)C)CO)CC=1C2=C(C=CC=C2)NC1)[C@@H](CC)C
Compound: Gibbosicolid D
SMILES: O=C1C=C2[C@@]3([C@H](C(C(=O)CC3)(C)C)C[C@@H]4[C@]2(O4)[C@]5([C@]1([C@@H](C(=C[C@@H]6OC(=O)[C@H](C6)C)C)C[C@H]5O)C)C)C
Compound: Epirodin A
SMILES: C(\C=C\C=C\C=C\C=C)=C/C=C/C=C/C=C
Compound: Ganoweberianic acid B
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)O)C)[C@@]4([C@H](O)C[C@@H]([C@]4(C1)C)[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C
Compound: 4-bromohamigeran K
SMILES: BrC1=C(O)C=2C(=O)[C@@H](O)[C@@]3(CC[C@@H]([C@@H]3C2C(=C1C)Br)C(C)C)C
Compound: 4'-deoxybutirosin B
SMILES: O=C(N[C@H]1[C@H](O[C@H]2O[C@H](CO)[C@@H]([C@@H]2O)O)[C@@H](O)[C@H](O[C@H]3O[C@H](C[C@H]([C@H]3N)O)CN)[C@H](C1)N)[C@@H](O)CCN
Compound: Cylindrocyclophane F4
SMILES: ClC(Cl)CCC[C@@H]1C2=C(O)C=C(C[C@H](CCCC[C@H](CCCC(Cl)Cl)C3=C(C=C(C[C@H](CCCC1)C)C=C3O)O)C)C=C2O
Compound: Gibbosicolid E
SMILES: O=C1C=C2[C@]([C@H](C(=C)C)C[C@@H]3[C@]2(O3)[C@]4([C@]1([C@@H](/C(=C/[C@@H]5OC(=O)[C@H](C5)C)/C)C[C@@H]4O)C)C)(CCC(=O)O)C
Compound: Ganoweberianic acid C
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)O)C)[C@@]4([C@H](O)C[C@@H]([C@]4([C@@H]1O)C)[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C
Compound: Sinapiquinone
SMILES: O=C1C(=O)C(=CC=2C1=C(O)C3=C(OC)C=C(OC)C=C3C2C4=C(O)C=5C(=O)C6=C(O)C=C(C)C=C6C(C5C=C4OC)=O)C
Compound: 4'-deoxybutirosin A
SMILES: O=C(NC1C(O)C(OC2OC(CO)C(C2O)O)C(OC3OC(CC(C3N)O)CN)C(C1)N)C(O)CCN
Compound: Gibbosicolid F
SMILES: O=C1C=C2[C@]([C@H](C(=C)C)C[C@@H]3[C@]2(O3)[C@]4([C@]1([C@@H](/C(=C/[C@@H]5OC(=O)[C@H](C5)C)/C)C[C@H]4O)C)C)(CCC(=O)O)C
Compound: Cytochalasin Z(22)
SMILES: O=C1O[C@]23C(=O)N[C@H]([C@@H]2[C@H](C)[C@@]4([C@H]([C@@H]3C=CC[C@@H](C([C@@](C=C1)(O)C)=O)C)O4)C)CC5=CC=CC=C5
Compound: Ganoweberianic acid D
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@@]4([C@H](O)C[C@@H]([C@]4([C@@H]1O)C)[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C
Compound: Pestalotheol B
SMILES: O=C1C2=C(OC(C1)(C)C)C[C@]3(O)C[C@@H](O[C@H]3C2)C(O)(C)C
Compound: Emerimicin IV
SMILES: O=C(N1[C@H](C(=O)NC(C(=O)N[C@@H](CO)CC2=CC=CC=C2)(C)C)C[C@@H](C1)O)[C@](NC(=O)[C@H](NC(=O)[C@H]3N(C(=O)C(NC(=O)C(NC(=O)[C@H](NC(=O)CNC(=O)[C@H](NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)[C@H](NC(=O)C)CC4=CC=CC=C4)(C)C)(C)C)(C)C)C(C)C)CC(C)C)(C)C)(C)C)C[C@@H](C3)O)CCC(=O)N)(CC)C
Compound: Pezizolide B
SMILES: O=C1OCC(=C1/C=C/C)CC[C@@]2(OC(=O)[C@@H](C2)O)C
Compound: Gibbosicolid G
SMILES: O=C1C=C2[C@]([C@H](C(=C)C)C[C@@H]3[C@]2(O3)[C@]4([C@]1([C@@H](C(=C[C@@H]5OC(=O)[C@H](C5)C)C)C[C@@H]4O)C)C)(CCC(=O)OC)C
Compound: Ganoweberianic acid E
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@@]4([C@H](O)C[C@@H]([C@]4([C@@H]1OC(=O)C)C)[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C
Compound: JBIR-148
SMILES: ClC1=CC(O)=C2C(C=3OC[C@](N3)(C(=O)N[C@H](C(=O)O)[C@@H]4NCCC4)C)=CN(C2=C1)C
Compound: Emerimicin III
SMILES: O=C(N1[C@@H](C(=O)N[C@H](C(=O)N[C@H](CO)CC2=CC=CC=C2)C)C[C@@H](C1)O)[C@@](NC(=O)[C@H](NC(=O)[C@H]3N(C(=O)C(NC(=O)C(NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)[C@@H](NC(=O)C)CC4=CC=CC=C4)(C)C)(C)C)(C)C)C(C)C)CC(C)C)(C)C)(C)C)C[C@@H](C3)O)CCC(=O)N)(CC)C
Compound: Laetiposide G
SMILES: O=C(OC1OC(C(O)C(C1O)O)CO)[C@@H]([C@@H]2[C@@]3([C@@](C4=C([C@@]5(C(C([C@@H](O)CC5)(C)C)CC4)C)CC3)(C)[C@H](C2)O)C)CCC(=C)C(C)C
Compound: Gibbosic acid I
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@@]4([C@H](O)C[C@@H]([C@]4([C@H]1O)C)/C(=C/C(=O)C[C@@H](C(=O)O)C)/C)C
Compound: Ganoweberianic acid F
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@@]4([C@H](O)C[C@@H]([C@]4(C1=O)C)[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C
Compound: Glaucopine A
SMILES: O=C1[C@@]2(C(=C(C(C)C)CC2)[C@H]3CC=C([C@H]([C@@H]([C@@]3(C1)C)O)OC)C=O)C
Compound: Ajudazol B
SMILES: O=C1O[C@H]([C@H](O)C=2C1=C(O)C(=CC2)C)[C@H](CC=3N=C(C(C\C=C/C=C\CC/C=C/CN(C(=O)/C=C(/OC)\C)C)C)OC3)C
Compound: Pentenomycin II
SMILES: O=C1C=C[C@@H]([C@@]1(O)CO)OC(=O)C
Compound: Ganoweberianic acid G
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CC[C@@H](C3(CO)C)O)C)[C@@]4([C@H](O)C[C@@H]([C@]4(C1)C)[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C
Compound: Methyl 3-chloro-2-(2,4-dimethoxy-6-methylphenoxy)-6-hydroxy-4-methoxybenzoate
SMILES: ClC1=C(OC2=C(OC)C=C(OC)C=C2C)C(=C(O)C=C1OC)C(=O)OC
Compound: (3S)-3beta-(3-Furyl)-4alpha-acetoxy-7alpha,5alpha-(epoxymethano)-5-methyl-3,4,5,6,7,8-hexahydro-1H-2-benzopyran-1,10-dione
SMILES: O=C1O[C@@H](C2=COC=C2)[C@H](OC(=O)C)C3=C1C[C@H]4OC([C@@]3(C4)C)=O
Compound: Hamigeran F
SMILES: BrC1=C(O)C2=C([C@@H]3[C@]4(CC[C@@H]3C([C@@]2(O)[C@@H](OC(=O)C)C4=O)(C)C)C)C=C1C
Compound: Pentenomycin I
SMILES: O=C1C=C[C@@H]([C@@]1(O)CO)O
Compound: Pestalotiphain A
SMILES: O=C(O[C@@H]1[C@]23OC(O)[C@@H]([C@H]2CC3(C)C)[C@@H](N4C5=NC=NC(=C5N=C4)N)[C@@H](C=C(C1)C)OC)C
Compound: C-15 iturin A
SMILES: O=C1N2[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)NC(CC(N[C@H](C(N[C@@H](C(N[C@@H](C(N[C@H]1CCC(=O)N)=O)CC(=O)N)=O)CC3=CC=C(O)C=C3)=O)CC(=O)N)=O)CCCCCCCCC(CC)C)CO)CC(=O)N)CCC2
Compound: Bromophilone A
SMILES: BrC=1C(=O)[C@](OC(=O)C[C@H](O)C[C@H](O)C)(C(=O)[C@@]2(C1C=C(OC2)/C=C/C=C/C=C/C(=O)O)CC3=C(C(O)=C(O)C(=C3)OC)C(=O)C)C
Compound: 6-hydroxy-8-methoxy-3alpha-methyl-3alpha,9beta-dihydro-3H-furo[3,2-c]isochromene-2,5-dione
SMILES: O=C1O[C@]2([C@H](OC(C2)=O)C=3C1=C(O)C=C(OC)C3)C
Compound: Bleomycin B1'
SMILES: S1C(=NC(=C1)C(=O)N)C=2N=C(CCNC(=O)[C@H](NC(=O)[C@@H]([C@H](O)[C@@H](NC(=O)[C@@H](NC(=O)C3=NC(=NC(=C3C)N)[C@@H](NC[C@@H](N)C(=O)N)CC(=O)N)[C@H](O[C@@H]4O[C@H]([C@@H](O)[C@H]([C@H]4O[C@@H]5O[C@@H]([C@@H](O)[C@H]([C@H]5O)OC(=O)N)CO)O)CO)C=6NC=NC6)C)C)[C@@H](O)C)SC2
Compound: 2-phenylethanaminium
SMILES: [NH3+]CCc1ccccc1
Compound: benzylaminium
SMILES: [NH3+]Cc1ccccc1
Compound: Pestalotiphain B
SMILES: O=C(O[C@@H]1[C@]23O[C@@](OC)(C=C([C@H]2CC3(C)C)CO)C=C(C1)C)C
Compound: Bromophilone B
SMILES: BrC=1C(=O)[C@@](OC(=O)C[C@H](O)C[C@H](O)C)(C(=O)[C@@]2(C1C=C(OC2)/C=C/C=C/C=C/C(=O)O)CC3=C(C(O)=C(O)C(=C3)OC)C(=O)C)C
Compound: Raocyclamide A
SMILES: S1C2=NC(=C1)C(=O)N[C@@H](C=3OC[C@@H](N3)C(=O)N[C@H](C4=NC(C(NC2[C@H](CC)C)=O)=CO4)C)CC5=CC=CC=C5
Compound: (2R)-2-hydroxy-1-(8-hydroxy-3-methylisoquinolin-7-yl)-3-methylbutan-1-one
SMILES: O=C(C1=C(O)C=2C(=CC(C)=NC2)C=C1)[C@H](O)C(C)C
Compound: Bleomycin A2'-C
SMILES: S1C(=NC(=C1)C(=O)NCCC=2NC=NC2)C=3N=C(CCNC(=O)[C@@H](NC(=O)[C@H]([C@H](O)[C@@H](NC(=O)[C@H](NC(=O)C4=NC(=NC(=C4C)N)[C@H](NC[C@@H](N)C(=O)N)CC(=O)N)[C@@H](O[C@H]5O[C@@H]([C@H](O)[C@H]([C@@H]5O[C@@H]6O[C@H]([C@H](O)[C@H]([C@@H]6O)OC(=O)N)CO)O)CO)C=7NC=NC7)C)C)[C@H](O)C)SC3
Compound: Streptcytosine J
SMILES: O=C1N=C(NC(=O)C(C)C)C=CN1[C@@H]2O[C@@H]([C@@H](O)CC2)C
Compound: Pestalotiphain C
SMILES: O=C(O[C@@H]1[C@@]2(O)C(C[C@@H]2[C@@H](C[C@@H](C=C(C1)C)OC)CO)(C)C)C
Compound: Hanabiratakelide B
SMILES: O=C1OCC=2C1=C(O)C(OC)=C(O)C2
Compound: 2'-methoxy-1'-hydroxy-beta,psi-caroten-4-one
SMILES: O=C1C(=C(/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/C=C/[C@@H](OC)C(O)(C)C)\C)\C)\C)/C)/C)C(C)(C)CC1)C
Compound: Bleomycin A2'-A
SMILES: S1C(=NC(=C1)C(=O)NCCCCN)C=2N=C(CCNC(=O)[C@H](NC(=O)[C@@H]([C@H](O)[C@@H](NC(=O)[C@@H](NC(=O)C3=NC(=NC(=C3C)N)[C@@H](NC[C@@H](N)C(=O)N)CC(=O)N)[C@H](O[C@@H]4O[C@H]([C@@H](O)[C@H]([C@H]4O[C@@H]5O[C@@H]([C@@H](O)[C@H]([C@H]5O)OC(=O)N)CO)O)CO)C=6NC=NC6)C)C)[C@@H](O)C)SC2
Compound: Pestalotiphain D
SMILES: O=C(O[C@@H]1[C@@]2(O)C(C[C@@H]2[C@H](C[C@@H](C=C(C1)C)OC)CO)(C)C)C
Compound: Nodulopeptin 917
SMILES: S(=O)(CC[C@@H]1NC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@H](C(C)C)NC([C@@H](CCCCNC1=O)NC(=O)N[C@H](C(=O)O)CC2=CC=CC=C2)=O)CCC3=CC=CC=C3)C)CCC4=CC=C(O)C=C4)C
Compound: Pestaloficiol L
SMILES: O=C(OC)C1=C(C(O)=CC(=C1)OC)C(=O)C2=C(O)C(C=3C4=C(OC(C3)(C)C)C(=CC(=C4)O)CC=C(C)C)=C(C)C=C2O
Compound: Streptcytosine M
SMILES: O=C1N=C(NC(=O)C=CC(C)C)C=CN1[C@@H]2O[C@@H]([C@@H](O)CC2)C
Compound: Bleomycin demethyl A2
SMILES: S1C(=NC(=C1)C(=O)NCCCSC)C=2N=C(CCNC(=O)[C@H](NC(=O)[C@@H]([C@H](O)[C@@H](NC(=O)[C@@H](NC(=O)C3=NC(=NC(=C3C)N)[C@@H](NC[C@@H](N)C(=O)N)CC(=O)N)[C@H](O[C@@H]4O[C@H]([C@@H](O)[C@H]([C@H]4O[C@@H]5O[C@@H]([C@@H](O)[C@H]([C@H]5O)OC(=O)N)CO)O)CO)C=6NC=NC6)C)C)[C@@H](O)C)SC2
Compound: Cytosaminomycin E
SMILES: O=C1N=C(NC(=O)CCC(C)C)C=CN1[C@@H]2O[C@@H]([C@@H](O[C@H]3O[C@@H]([C@@H](N(C)C)[C@@H]([C@H]3O)O)C)CC2)C
Compound: Cladonioidesin
SMILES: O=C(OC1=C(C(O)=C(C(=O)OC)C(=C1)C)C)C2=C(O)C(=C(O)C=C2C)C(=O)O
Compound: Pestalotiphain E
SMILES: O=C(O[C@@H]1[C@@]2(O)C(C[C@@H]2[C@@H](C[C@@H](C=C(C1)C)O)CO)(C)C)C
Compound: Bactobolin D
SMILES: ClC(Cl)[C@]1(OC(=O)C2=C(O)C[C@H](C[C@H]2[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](N)C)C)O)C
Compound: Dehydroherbarin
SMILES: O=C1C2=C(C(=O)C3=C1C=C(OC)C=C3OC)COC(=C2)C
Compound: Streptcytosine F
SMILES: O=C1N=C(NC(=O)CC(O)(C)C)C=CN1[C@@H]2O[C@@H]([C@@H](O)CC2)C
Compound: 4-aminofolic acid
SMILES: Nc1nc(N)c2nc(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cnc2n1
Compound: Sorbicillamine D
SMILES: O=C1C(=C(O)/C(=C(\O)/C=C/C=C/C)/[C@H]2[C@@]1(O[C@@]3(O)[C@@](O)(C(=N)C(C([C@@]23C)=O)=C(O)/C=C/C=C/C)C)C)C
Compound: Pestalotiphain F
SMILES: O=C1[C@H](OC)C=C(C[C@@H]([C@@]2([C@@H]([C@H]1CO)CC2(C)C)O)OC(=O)C)C
Compound: Antascomicin C
SMILES: O=C1N2[C@H](C(=O)O[C@H]([C@@H](C[C@H]3[C@H](O)[C@@H](OC)[C@H](O)CC3)C)CC[C@@H](C=CCCC=CC([C@@H]([C@H]4O[C@](C1=O)(O)[C@@H](CC4)C)C)=O)C)CCCC2
Compound: Herbarin
SMILES: O=C1C2=C(OC)C=C(OC)C=C2C(=O)C3=C1CO[C@](C3)(O)C
Compound: Streptcytosine G
SMILES: O=C1N=C(NC(=O)C=C(C)C)C=CN1[C@@H]2O[C@@H]([C@@H](O)[C@@H](C2)O)C
Compound: Pestalotiphain G
SMILES: O=C(O[C@@H]1[C@@]2(O)C(C[C@@H]2C(=C[C@H](C=C(C1)C)O)CO)(C)C)C
Compound: Gabetaericin B2
SMILES: S(CC(N)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N[C@@H](C(=O)N)[C@@H](O)C)CC(=O)N)CCCCN)CCC(=O)O)CCC1)CCCCN)CO)C(CC)C)C
Compound: 16-deoxyporicoic acid B
SMILES: O=C(O)C([C@@H]1[C@@]2([C@@](C=3C([C@]([C@H](C(=C)C)CC3)(CCC(=O)O)C)=CC2)(C)CC1)C)CCC=C(C)C
Compound: T-2636 E
SMILES: O=C1C(=CCC(OC(=O)C)C=CC(=CCC(C=CC(=CC(C1C)NC(=O)C(O)C)C)O)C)C
Compound: 18-hydroxydecaturin B
SMILES: O=C1OC(C2=CN=CC=C2)=CC3=C1[C@H](O)[C@@]4(C(=C[C@H](O)[C@H]5[C@]4(CC[C@@H]6[C@@]57CO[C@@](C6(C)C)(O)CC7)C)C)O3
Compound: Streptcytosine H
SMILES: O=C1N=C(NC(=O)C)C=CN1[C@@H]2O[C@@H]([C@@H](O)CC2)C
Compound: Drophiobolin B
SMILES: O=C1C(=C2C(=O)C=C([C@H]2C[C@@]3([C@@H](C1)[C@]4(O[C@@H](C=C(C)C)C[C@@H]4C)CC3)C)C)CO
Compound: Monacyclinone E
SMILES: O=C1C2=C(O)C(=CC=C2C(=O)C3=C1C=CC(=C3O)C[C@@](O)(CC(=O)O)C)[C@@H]4O[C@H]([C@@H](N(C)C)CC4)C
Compound: T-2636 D
SMILES: O=C1O[C@H]2[C@@H](C)C([C@@]1([C@H](NC(=O)C(O)C)C=C(C=C[C@@H](O)CC=C(C=C[C@H](C2)OC(=O)C)C)C)C)=O
Compound: Streptcytosine I
SMILES: O=C1N=C(NC(=O)CC)C=CN1[C@@H]2O[C@@H]([C@@H](O)CC2)C
Compound: Pyrindamycin B
SMILES: Cl[C@@H]1CN(C=2C=C(O)C3=C(C2C1)C(=O)[C@@](C(=O)OC)(C)N3)C(=O)C=4NC=5C(OC)=C(OC)C(=CC5C4)OC
Compound: Desotamide C
SMILES: O=C1N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(N[C@@H](C(N[C@H]1[C@@H](CC)C)=O)CC(C)C)=O)CC(C)C)CC(=O)C2=C(NC=O)C=CC=C2)CC(=O)N
Compound: Drophiobolin A
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(=CC[C@H]3[C@@](O)([C@H](CCCC(O)(C)C)C)CC[C@@]3(C2)C)C=O
Compound: Azalomycin F5
SMILES: O=C1O[C@H]([C@H](C=CC=C([C@H](O)C[C@H](O)C[C@@H](OC(=O)CC(=O)O)C[C@@H](O)C[C@@H]2O[C@@](C[C@H]([C@H](CC[C@@H]([C@@H]([C@H](C[C@H]([C@@H](C=CC=C1C)C)O)O)C)O)C)O)(O)[C@@H](O)[C@@H](C2)O)C)C)[C@H](CCC/C=C/CCCNC(=NC)NC)C
Compound: Streptcytosine O
SMILES: O=C1N=C(NC(=O)C2=CC=C(NC(C(=O)C)C)C=C2)C=CN1[C@@H]3O[C@@H]([C@@H](O)CC3)C
Compound: Delaminomycin A
SMILES: O=C1NC(O)C(C1=C(O)C2(C3C(C=CC2CC(O)/C=C/C=C/C(C(O)CC)C)CC(C)CC3C)C)=O
Compound: D-Asp3,(E)-Dhb 7]-MC-HtyY
SMILES: O=C/1N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)CC(=O)N[C@@H](CC2=CC=C(O)C=C2)C(N[C@H]([C@@H](C(N[C@H](CCC(N\C1=C\C)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC)CC3=CC=CC=C3)C)/C)=O)CCC4=CC=C(O)C=C4)C
Compound: alpha-sulfophenylacetic acid
SMILES: OC(=O)C(c1ccccc1)S(O)(=O)=O
Compound: Penisarin A
SMILES: O=C1OC2=C(C(=CC(=C2)OC)C)C3=C1C[C@@H]([C@@]4([C@@]5([C@H](C(C(=O)CC5)(C)C)CC4)C)C)O3
Compound: Azalomycin F4
SMILES: O=C1O[C@@H]([C@@H](C=CC=C([C@@H](O)C[C@H](O)C[C@@H](OC(=O)CC(=O)O)C[C@@H](O)C[C@H]2O[C@@](C[C@H]([C@@H](CC[C@@H]([C@H]([C@H](C[C@H]([C@H](C=CC=C1C)C)O)O)C)O)C)O)(O)[C@@H](O)[C@@H](C2)O)C)C)[C@H](CCC/C=C/CCCNC(=NC)N)C
Compound: Streptcytosine L
SMILES: O=C1N=C(NC(=O)CC=C(C)C)C=CN1[C@@H]2O[C@@H]([C@@H](O)CC2)C
Compound: Xyolide
SMILES: O=C1O[C@@H]([C@@H](O)[C@@H](O)C=C[C@H](CC1)OC(=O)CCC(=O)O)CCCCCCC
Compound: Mitibetaimol B
SMILES: O=C1C(=CCC[C@]2(O[C@@H]2[C@H](C(C=C1)(C)C)O)C)C
Compound: Penisarin B
SMILES: O=C1OC2=C(C(=CC(=C2)OC)C)C3=C1C[C@@H]([C@@]4([C@@]5([C@H](C([C@@H](O)CC5)(C)C)CC4)C)C)O3
Compound: BY-81
SMILES: O=C1NC[C@@H](O)[C@@H]2[C@@H]1N=C(N[C@@H]3O[C@@H]([C@H](OC(=O)N)[C@H]([C@H]3N(C(=O)CN=CN)C)O)CO)N2
Compound: Streptcytosine N
SMILES: O=C1N=C(NC(=O)CC2=CC=CC=C2)C=CN1[C@@H]3O[C@@H]([C@@H](O)CC3)C
Compound: 4,6-Decadiyne-1,3,8,10-tetraol
SMILES: OC(C#CC#CC(O)CCO)CCO
Compound: Tornabeatin D
SMILES: O=C/1O[C@](CO)(C)C\C1=C\CCCCCCCCCCCCCCC
Compound: Fusaindoterpene A
SMILES: O=C1O[C@@]2([C@@]3([C@H]([C@]4([C@@H](O[C@H](C4)C=C(C)C)CC3)C)CC[C@H]2CC(C5=C(N1)C=CC=C5)=O)C)C
Compound: MBJ-0110
SMILES: O=C1O[C@@H]2C[C@H](NCC2)C(=O)N[C@H](C(=O)O)CC(=O)N3[C@H](C(N4[C@H](C(N[C@H]1[C@H](CC)C)=O)CCCC4)=O)CCC3
Compound: Streptcytosine K
SMILES: O=C1N=C(NC(=O)CCC(C)C)C=CN1[C@@H]2O[C@@H]([C@@H](O)CC2)C
Compound: Papyracillic acid methyl Acetal
SMILES: O=C1O[C@]2(O[C@](OC)(C)[C@H](C2=C)C)C(=C1)OC
Compound: Fusaindoterpene B
SMILES: O=C(O[C@@H]1[C@]([C@H]2[C@]([C@]3(C=4NC=5C=CC=CC5C4C[C@@H]3CC2)C)(C)CC1)(CCC=C(C)C)C)COC(=O)C
Compound: Phenelfamycin H
SMILES: O=C(O)/C=C/C=C/C=C/[C@@H]1O[C@@H]([C@@H]([C@H](OC)/C(=C/C=C/CNC(=O)[C@H]([C@]2(O[C@@H](/C=C/C=C/CO)C(C)(C)[C@H]([C@H]2O)OC(=O)CC3=CC=CC=C3)O)CO[C@@H]4O[C@H]([C@@H](O[C@H]5O[C@H]([C@H](O[C@@H]6O[C@H]([C@@H](O)[C@H](C6)OC)C)[C@@H](C5)OC)C)[C@H](C4)OC)C)/C)C)C[C@@H]1O
Compound: Penicyrone A
SMILES: O=C1OC(=C(C)C(=C1C)OC)[C@@](O)(C=C([C@@H](O)C(=C[C@@]2(O[C@H](C)[C@@]3([C@H]2O3)C)C)C)C)C
Compound: 4-epi-citreoviridin
SMILES: O=C1OC(=C(C)C(=C1)OC)/C=C/C=C/C=C/C(=C/[C@@]2(O[C@H](C)[C@@]([C@@H]2O)(O)C)C)/C
Compound: Bacillamide
SMILES: S1C(=NC(=C1)C(=O)NCCC=2C3=C(C=CC=C3)NC2)C(=O)C
Compound: (4E,6E)-2,4,6-trimethylocta-4,6-dien-3-one
SMILES: O=C(/C(=C/C(=C/C)/C)/C)C(C)C
Compound: Penicyrone B
SMILES: O=C1OC(=C(C)C(=C1C)OC)[C@@](O)(C=C([C@H](O)C(=C[C@@]2(O[C@H](C)[C@@]3([C@H]2O3)C)C)C)C)C
Compound: Fusariumindole A
SMILES: O=C(OCCC=1NC=2C=CC=CC2C1)CC=3C4=C(C=CC=C4)NC3
Compound: 21-Bromooscillatoxin A
SMILES: BrC1=C(C=C(O)C=C1)[C@@H](OC)CC[C@@H](C2O[C@@]34O[C@](O)([C@H](C)CC3(C)C)CC(=O)O[C@H](CC(O[C@H]([C@@H]2C)C4)=O)CO)C
Compound: (20R)-7,8-dihydroxypaxisterol
SMILES: O1[C@@]([C@H]2C[C@H]3O[C@@H]1[C@@]42[C@@H]3[C@]5(O)[C@@H](O)C[C@H]6C[C@@H](O)CC[C@@]6([C@H]5CC4)C)(CCC(=C)C(C)C)C
Compound: Oxirapentyn H
SMILES: O=C(O[C@H]1C(O[C@H]2[C@H](O)[C@@](O)(C#CC(=C)C)[C@H]([C@@H]([C@@]2(C1)O)O)O)(C)C)C
Compound: 15-glycidylfilipin III
SMILES: O=C1O[C@@H]([C@@H](O)C=CC=CC=CC=CC=C([C@@H](OC[C@H](O)CO)[C@H]([C@@H](C[C@@H](C[C@@H](C[C@@H](C[C@@H](C[C@@H]([C@H]1[C@H](O)CCCCC)O)O)O)O)O)O)O)C)C
Compound: Fusariumindole B
SMILES: O=C(OC)CC=1C2=C(C=CC=C2)NC1CC=3C4=C(C=CC=C4)NC3
Compound: Auransterol
SMILES: O1[C@@]23[C@H](O)C[C@H]4C[C@@H](O)CC[C@@]4([C@H]2CC[C@]56[C@H]1O[C@](CCC(=C)C(C)C)(C)[C@H]5C[C@H]([C@@H]36)O)C
Compound: (3R,4aR,12bS)-9-[(1R,3R,5S,8S,10R,12R,14R)-5,14-dimethyl-6-oxo-2,4,9,13-tetraoxatricyclo[8.4.0.03,8]tetradecan-12-yl]-4a,8,12b-trihydroxy-3-methyl-3-[(2S,5S,6S)-6-methyl-5-[[(2R,6S)-6-methyl-5-oxo-2H-pyran-2-yl]oxy]oxan-2-yl]oxy-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
SMILES: O=C1C2=C(O)C(=CC=C2C(=O)C3=C1C=C[C@]4([C@]3(O)C(=O)C[C@@](O[C@@H]5O[C@H]([C@@H](O[C@@H]6O[C@H](C(=O)C=C6)C)CC5)C)(C)C4)O)[C@@H]7O[C@@H]([C@H]8O[C@@H]9O[C@@H](C)C(C[C@@H]9O[C@@H]8C7)=O)C
Compound: Brevigellin
SMILES: O=C1N2C(C(=O)N3C=C(CCCC(=O)NC(CC(OC(C(C(NC1C)=O)NC(=O)C4=CC=CC=C4)C)=O)C)CC3)CCC2
Compound: 16beta, 17beta-epoxyfilipin V
SMILES: O=C1O[C@@H]([C@@H](O)C=CC=CC=CC=C[C@@H]2O[C@]2([C@H](O)[C@H]([C@@H](C[C@@H](C[C@@H](C[C@@H](C[C@@H](C[C@@H]([C@H]1[C@H](O)CCCCC)O)O)O)O)O)O)O)C)C
Compound: Fusariumindole C
SMILES: O=C(O[C@@H](C(=O)O)CC1=CC=CC=C1)C=2C3=C(C=CC=C3)NC2
Compound: (7S)-5-en-auransterol
SMILES: O1[C@@]23[C@@H](O)C=C4C[C@@H](O)CC[C@@]4([C@H]2CC[C@]56[C@H]1O[C@](CCC(=C)C(C)C)(C)[C@H]5C[C@H]([C@@H]36)O)C
Compound: 7-acetyl-10-methoxydihydrobotrydial
SMILES: O=C(O[C@@H]1[C@@H]2[C@@]3(O)[C@](CO[C@@H]([C@H]3[C@@H](C1)C)OC)(C)[C@@H](C2(C)C)OC(=O)C)C
Compound: Roseobacticide I
SMILES: S(C=1C=C2OC(=O)C(=C2C=CC1)C3=CC=CC=C3)C4=CC=C(O)C=C4
Compound: 16alpha, 17alpha-epoxyfilipin V
SMILES: O=C1O[C@@H]([C@@H](O)C=CC=CC=CC=C[C@H]2O[C@@]2([C@@H](O)[C@H]([C@@H](C[C@@H](C[C@@H](C[C@@H](C[C@@H](C[C@@H]([C@H]1[C@H](O)CCCCC)O)O)O)O)O)O)O)C)C
Compound: (+/-)-Isoalternatine A
SMILES: O=C(O[C@@H]([C@@H](O)C)C)CC=1C2=C(C=CC=C2)NC1
Compound: Asperpyridone A
SMILES: O=C1N(OC)C=CC2=C1[C@H]3[C@@H](C[C@H](C)C[C@@H]3C)[C@@H](O2)C
Compound: Langkocycline B2
SMILES: O=C1OC=2C=3C(C(O)=C4C2[C@@]5(O[C@@H]6O[C@H]([C@@H](O[C@@H]7O[C@@H]([C@@H](O)[C@@H](C7)O[C@H]8O[C@@H]([C@H](O[C@H]9O[C@H]([C@H](O)[C@H](C9)O[C@H]%10O[C@@H]([C@H](O)CC%10)C)C)CC8)C)C)CC6)C)C(=O)C[C@@](O)(C)C[C@@]5(O)C=C4)=C(O)C=CC3C1=C%11C%12=C(C=CC=C%12)N=C%11
Compound: Carbonarin J
SMILES: O=C1C=2C(OC(=C1)C)=C(C3=CC(OC)=CC(=C3C2O)OC)C4=C(O)C=CC(=C4)C=5C(=O)NCC5CC6=CC(OC)=C(O)C=C6
Compound: Amycolasporin A
SMILES: O=C1C2=C(C=NC(=C2)C(=O)N)CC1
Compound: Rocheicoside A
SMILES: O=C1N=C(NC(=O)C2=CC=C(N3C(=O)[C@](CO)(C)NC3)C=C2)C=CN1[C@@H]4O[C@@H]([C@@H](O[C@H]5O[C@@H]([C@@H](N(C)C)[C@@H]([C@H]5O)O)C)CC4)C
Compound: Yangpumicin F
SMILES: O=C1C2=C3N[C@H]4C#CC=CC#C[C@H]([C@]5(C3=CC(=C2C(=O)C=6C1=C(O)C=CC6)O)O[C@@]45[C@H](O)CO)O
Compound: Tremulenolide B
SMILES: O=C1OC[C@@H]2[C@H]1C3=CC(C)(C)C[C@H]3[C@@H](C)CC2
Compound: Demethyl-balhimycin
SMILES: ClC1=C2OC3=C(O[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO)C=5OC6=C(Cl)C=C([C@@H](O[C@@H]7O[C@H](C(=O)[C@](C7)(N)C)C)[C@H]8C(=O)N[C@@H](C(=O)O)C=9C(C=%10C=C([C@@H](NC([C@@H](C(=C3)C5)NC(=O)C(NC([C@@H]([C@@H](C(=C1)C=C2)O)NC(=O)[C@H](N)CC(C)C)=O)CC(=O)N)=O)C(=O)N8)C=CC%10O)=C(O)C=C(O)C9)C=C6
Compound: Amycolasporin B
SMILES: O=C1C2=C(C=NC(=C2)C(=O)N)[C@@H](C1)OC
Compound: 4-amino-N-(2,4-dioxo-1H-pyrimidin-6-yl)benzamide
SMILES: O=C1NC(NC(=O)C2=CC=C(N)C=C2)=CC(N1)=O
Compound: Yangpumicin G
SMILES: O=C1C2=C3N[C@H]4C#CC=CC#C[C@H]([C@]5(C3=CC(=C2C(=O)C6=C1C=CC=C6)O)O[C@@]45[C@H](O)CO)O
Compound: 19,20-Epoxycytochalasin D
SMILES: O=C1[C@](O)([C@@H]2O[C@H]2[C@@H](OC(=O)C)[C@@]34C(=O)N[C@H]([C@@H]3[C@H](C)C([C@H](C4C=CC[C@@H]1C)O)=C)CC5=CC=CC=C5)C
Compound: Amycolasporin C
SMILES: O=C(N)C1=NC=C2C=C[C@@](C2=C1)(O)C(=O)OC
Compound: 3-hydroxy-2-oxo-2H-chromene-4,6-dicarboxylic acid
SMILES: O=C1OC2=C(C=C(C(=O)O)C=C2)C(=C1O)C(=O)O
Compound: Scabronine J
SMILES: O=CC1=CC=C2C3=C(C(CO)C)CC[C@]3(CO)CC[C@]2([C@H](C1)OC)C
Compound: Microcolin E
SMILES: O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](C[C@@H](CCCC)C)C)C)C=C(C)C)[C@H](OC(=O)C)C)C)C(C)C)CCC2)[C@@H](C)C=C1
Compound: JBIR-67
SMILES: O=C(O)C1=CC2=C(N[C@H](C2)[C@@](O)(CCC=C(C)C)C)C=C1
Compound: Amycolasporin D
SMILES: O=C/1C2=C(C=NC(=C2)C(=O)N)C\C1=C/C3=CC=C(O)C=C3
Compound: 6,6'-dihydroxy-(1,1′-biphenyl)-3,3′-dicarboxylic acid
SMILES: O=C(O)C1=CC(=C(O)C=C1)C2=C(O)C=CC(=C2)C(=O)O
Compound: Spirostaphylotrichin U
SMILES: O=C1C=C/C(=C/CC)/[C@]2([C@@H]1O)C(=O)N(OC)[C@]([C@@H]2O)(O)C
Compound: Microcolin F
SMILES: O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](C[C@@H](CCCC)C)C)C)C=C(C)C)[C@H](OC(=O)C)C)C)C(C)C)C[C@H](C2)O)[C@@H](C)C=C1
Compound: Aurovertin G
SMILES: O=C1OC(=C(C)C(=C1)OC)/C=C/C=C/C=C/[C@@H]2O[C@]3([C@@](O)([C@@H](O)C)O[C@@]([C@H]2O)(C)[C@@H]3OC(=O)C)C
Compound: Amycolasporin E
SMILES: O=C(N)C=1OC=C2C=CC(=C2C1)C(=O)O
Compound: 3,6-dihydroxy-2-propylbenzaldehyde
SMILES: O=CC1=C(O)C=CC(=C1CCC)O
Compound: Pitholide A
SMILES: O=C1O[C@@]2([C@H](O)C3=COC(=CC3=C(C2=C1C(=O)CCCCC[C@H](O)C)C=O)C)C
Compound: Microcolin G
SMILES: O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](C[C@@H](CCCC)C)C)C)C=C(C)C)[C@H](O)C)C)C(C)C)C[C@H](C2)O)[C@@H](C)C=C1
Compound: Falconensin N
SMILES: ClC1=C(OC)C(=C(C)C(=C1O)Cl)C(=O)O[C@]2(C(=O)C=C3C=C(CCC)OC[C@H]3[C@@H]2O)C
Compound: Amycolabenzoyl
SMILES: O=C(C1=C(O)C=C(OC)C=C1)[C@@H](O)C2=CC=C(O)C=C2
Compound: (7R)-7-hydroxydeoxyspectinabilin
SMILES: O=[N+]([O-])C1=CC=C(/C=C(/C=C(/C=C(/C=C(/C[C@@H](O)C=2OC(OC)=C(C)C(C2C)=O)\C)\C)\C)\C)C=C1
Compound: 1-O-TBSA-2-O-palmitoyl-sn-phospholipid
SMILES: P(=O)(OC[C@H](OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCC[C@@H](CCCCCCCC)C)(OCCN)O
Compound: Microcolin H
SMILES: O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](CCCCCC)C)C)CC(C)C)[C@H](OC(=O)C)C)C)C(C)C)C[C@H](C2)O)[C@@H](C)C=C1
Compound: Sydoxanthone B
SMILES: S(C1=C(C=2C(=O)C3=C(C=C(CO)C=C3O)OC2C=C1)C(=O)OC)C
Compound: Amycolabenzoside A
SMILES: O=C(C1=C(O[C@@H]2O[C@H]([C@H](O)[C@H]([C@H]2O)O)C)C=C(OC)C=C1)CC3=CC=C(O)C=C3
Compound: Zincmethylphyrin I
SMILES: [Zn+2].O=C(O)CCC=1C=2N=C(C1C)C=C3NC(=CC=4NC(C=C5N=C(C2)C(=C5CCC(=O)O)C)=C(C4CCC(=O)O)C)C(=C3CCC(=O)O)C
Compound: Microcolin I
SMILES: O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](CCCCCC)C)C)CC(C)C)[C@H](OC(=O)C)C)C)C(C)C)CCC2)[C@@H](C)C=C1
Compound: Karnamicin C3
SMILES: S1C(=NC(=C1)C2=NC(=C(O)C(=C2OC)OC)C(=O)N)CCC(C(O)C)C
Compound: Sarcosone C
SMILES: O=C1C=C(OC)[C@H](O)[C@@H]([C@@]12[C@H](C(O)(C)C)C2)O
Compound: Verrulactone E
SMILES: O=C1OC2=C3C(=C(O)C(=C2)O)[C@H]4[C@]5(OC(=O)C=6C(O)=CC(=CC6C5=CC([C@]4(C=7C3=C1C(O)=CC7OC)O)=O)OC)C
Compound: Amycolabenzoside B
SMILES: O=C(C1=C(O[C@@H]2O[C@H]([C@H](O)[C@H]([C@H]2O)O)C)C=C(O)C=C1)C(=O)C3=CC=C(O)C=C3
Compound: Microcolin K
SMILES: O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](C[C@@H](CCCC)C)C)C)CC(C)C)[C@H](OC(=O)C)C)C(C)C)CCC2)[C@@H](C)C=C1
Compound: Lucidimine A
SMILES: O1C2=C(C=3N=CC4=C(C3C1)CC[C@@H]4OC)C=C(O)C=C2
Compound: Cystochromone F
SMILES: O=C1C2=C(OC(=C1)CC(O)C)C=C(O[C@@H]3O[C@H]([C@H](O)[C@H]([C@H]3O)O)C)C=C2CCCCCC(=O)CCCCCCCC(O)(C)C
Compound: Verrulactone D
SMILES: O=C1C2=C(OC3=C1C=C(C4=C(C(O)=CC(=C4)OC)C(=O)O)C(=C3)C)C(O)=CC(=C2C)C5=C(C(O)=CC(=C5)OC)C(=O)O
Compound: (R)-3-methyl-1,3-dihydroisobenzofuran-4,6-diol
SMILES: O1[C@@H](C=2C(O)=CC(=CC2C1)O)C
Compound: Microcolin J
SMILES: O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](C[C@@H](CCCC)C)C)C)CC(C)C)[C@H](OC(=O)CC)C)C)C(C)C)C[C@H](C2)O)[C@@H](C)C=C1
Compound: cyclooctene
SMILES: [H]C1=CCCCCCC1
Compound: Lapstatin
SMILES: O=C(O)C(NC(=O)C(O)C(N)C(C)C)C(C)C
Compound: Farnesylemefuranone A
SMILES: O=C1OCC2=C1C=C(OC)C(=C2O)OC/C=C(/CC/C=C(/CCC(=O)C(C)C)\C)\C
Compound: Microcolin L
SMILES: O=C1N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](C[C@@H](CCCC)C)C)C)C[C@@H](CC)C)[C@H](OC(=O)C)C)C)C(C)C)C[C@H](C2)O)[C@@H](C)C=C1
Compound: Verticilactam C
SMILES: O=C1NC[C@@H](C=CC=CC=C([C@@H]2[C@H]3[C@H](CC(C1)=O)O[C@@H]4[C@H](O)C[C@@H]([C@@H]([C@H]34)C=C2)O)C)C
Compound: Juglomycin B
SMILES: O=C1C2=C(C(=O)C=C1[C@@H]3OC(=O)C[C@H]3O)C(O)=CC=C2
Compound: 3,5,8-trihydroxy-6-methoxy-2-(5-oxohexa-1,3-dienyl)-1,4-naphthoquinone
SMILES: O=C1C2=C(O)C(O)=C(/C=C/C=C/C(=O)C)C(=C2C(=O)C=C1OC)O
Compound: Farnesylemefuranone B
SMILES: O=C1OCC2=C1C=C(O)C(=C2O)OCC/C(=C/C=C/[C@H](CCC(=O)C(C)C)C)/C
Compound: Verticilactam B
SMILES: O=C1NC[C@H](C=CC=CC=C([C@@H]2[C@H]3[C@H](CC(C1)=O)O[C@@H]4[C@H](O)C[C@@H]([C@@H]([C@H]34)C=C2)O)C)C
Compound: Microcolin M
SMILES: O=C(O)[C@H]1N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](C[C@@H](CCCC)C)C)C)CC(C)C)[C@H](OC(=O)C)C)C)C(C)C)C[C@H](C1)O
Compound: (3S,6aR,7R,12R,12aS)-3,6a,7,12-tetrahydroxy-8-methoxy-3-methyl-4,7,12,12a-tetrahydro-2H-benzo[a]anthracen-1-one
SMILES: O=C1C2=C(C=C[C@]3([C@@H]2[C@@H](O)C=4C=CC=C(C4[C@H]3O)OC)O)C[C@@](C1)(O)C
Compound: Illinitone B
SMILES: O=C1C2=C(C=C(O)C(=C2)C)[C@](O)(C)C(C1=O)(C)C
Compound: Farnesylemefuranone C
SMILES: O=C1OCC2=C1C=C(O)C(=C2O)OCC/C(=C/CC/C(=C/C[C@H](O)C(O)(C)C)/C)/C
Compound: Penerpene E
SMILES: O=C1[C@@H]2[C@@]3(O[C@@]4([C@H]2OC(C)(C)[C@H]4O)O)[C@]([C@]5(C=6NC=7C=CC=CC7C6C[C@@H]5CC3)C)(C)CC1
Compound: Aniquinazoline C
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@](O)(NC([C@H]2CC(O)([C@H]4N(C5=CC=CC=C5)C(=O)[C@@H](N4)C(C)C)C)=O)C
Compound: 7-(4-methoxybenzyl)-4,5,6,7-tetrahydro-1,3-oxazepine-5,6-diol
SMILES: O1C=NC[C@@H]([C@@H]([C@@H]1CC2=CC=C(OC)C=C2)O)O
Compound: Azodyrecin B
SMILES: O=C(OC)[C@@H](N=[N+]([O-])/C=C\CCCCCCCCCC(CC)C)C
Compound: Cysfluoretin
SMILES: S(CC1=CC(OC)=C2C=3C(O)=C4C(=O)CCC(C4=C(C3CC2=C1)O)OC)CC(NC(=O)C)C(=O)O
Compound: Azodyrecin C
SMILES: O=C(OC)[C@@H](N=[N+]([O-])/C=C\CCCCCCCCCCCC(C)C)C
Compound: Mutadione D
SMILES: O=C1OC=2C=C(O)C(=C(C2[C@]13C(=O)C(O)=C(C3=O)CCCCCCCCCCCCCCC)CCCCCCCCCCCCCCC)O
Compound: Penerpene F
SMILES: O=C1C=C2[C@@]3(O)[C@@]([C@]4(C=5NC=6C=CC=CC6C5C[C@@H]4CC3)C)(CC[C@@H]2OC1)C
Compound: Xylarinol C
SMILES: O=C1OCC=2C(O)=CC=C(C2C=C1)CC=C(C)C
Compound: Psychrophilin A
SMILES: O=[N+]([O-])[C@@H]1C(=O)N2[C@H](C(=O)NC=3C=CC=CC3C(N4C=C(C1)C5=C4C=CC=C5)=O)CCC2
Compound: Penerpene G
SMILES: O=C1O[C@H](O[C@@H]2C(=C1)[C@@]3(O)[C@@]([C@]4(C=5NC=6C=CC=CC6C5C[C@@H]4CC3)C)(CC2)C)C(O)(C)C
Compound: Emefuran B1
SMILES: O=C([C@@H](O)CCCCC)C[C@@H]1OCC=2C1=C(C=CC2O)CC=C(C)C
Compound: Azodyrecin A
SMILES: O=C(OC)[C@@H](N=[N+]([O-])/C=C\CCCCCCCCCC(C)C)C
Compound: Cystothiazole C
SMILES: S1C(=NC(=C1)/C=C/[C@H](O)[C@H](/C(/OC)=C\C(=O)OC)C)C=2N=C(C(C)C)SC2
Compound: Ganodermalactone B
SMILES: O=C1OC([C@@H]2CCC3=C([C@]2(CC1)COC(=O)C)CC[C@]4([C@]3(CC[C@@H]4[C@@H]([C@H]5OC(=O)C(C)=CC5)C)C)C)(C)C
Compound: Penerpene H
SMILES: O=C1C=C2[C@@]3(O)[C@@]([C@]4(C=5NC=6C=CC=CC6C5C([C@@H]4CC3)=O)C)(CC[C@@H]2O[C@@H]1C(O)(C)C)C
Compound: Emefuran B2
SMILES: O=C([C@@H](O)CCCCC)C[C@H]1OCC=2C1=C(C=CC2O)CC=C(C)C
Compound: 1′-trans-Azodyrecin A
SMILES: O=C(OC)[C@@H](N=[N+]([O-])/C=C/CCCCCCCCCC(C)C)C
Compound: Hueafuranoid D
SMILES: O=C(CC(O)([C@H]1O[C@@](/C=C/CC(O)(C=C)C)(C)CC1)C)CC(C)C
Compound: Esperamicin O1
SMILES: S(=O)(C1C(O)CC(ONC2C(O)C(OC3OCC(NC(C)C)C(C3)OC)C(O[C@H]4C#CC=CC#C[C@]5(\C(\C4=C(NC(=O)OC)C(=O)C5OC6OC(C(O)C(C6)OC(=O)C7=C(NC(=O)C(OC)=C)C=C(OC)C(=C7)OC)C)=C\CSSSC)O)OC2C)OC1C)C
Compound: Emefuran C1
SMILES: O=C([C@@H](OC(=O)C)CCCCC)C[C@@H]1OCC=2C1=C(C=CC2O)CC=C(C)C
Compound: Penerpene I
SMILES: O=C1C=C2[C@@]3(O)[C@@]([C@@](C(=O)O)([C@H](CC(=O)C4=C(N)C=CC=C4)CC3)C)(CC[C@@H]2O[C@@H]1C(O)(C)C)C
Compound: 1′-trans-Azodyrecin B
SMILES: O=C(OC)[C@@H](N=[N+]([O-])/C=C/CCCCCCCCCC(CC)C)C
Compound: Gobienine C
SMILES: O=C1O[C@H]2[C@H](O[C@H]3[C@H](O[C@H](CCCCCCCCCCCCC[C@H]4[C@H]1[C@@H](C(=O)O4)C)C)O[C@H](CO)[C@H]([C@@H]3O)O)O[C@H](CO)[C@H]([C@@H]2O[C@@H]5O[C@H]([C@H](O)[C@H]([C@H]5O)O)C)O
Compound: Moriniafungin B
SMILES: O=C1O[C@]2([C@H](OC)[C@H](O[C@H]([C@H]2O)OC[C@]34[C@@]5(C(C(C)C)=C[C@H]3C[C@]5(C=O)[C@@H]6CC[C@H]([C@H]6C4)C)C(=O)O)C)O[C@H]1CCCCCC(=O)O
Compound: Emefuran C2
SMILES: O=C([C@@H](OC(=O)C)CCCCC)C[C@H]1OCC=2C1=C(C=CC2O)CC=C(C)C