MonarchInit/C3PO huggingface dataset:
Compound: 18-bromooctadeca-5,7,17-triynoic acid
SMILES: BrC#CCCCCCCCCC#CC#CCCCC(=O)O
Compound: Fusarester B
SMILES: O=C1C(=C(OC(=C1)/C(=C/[C@H](C[C@H](CC)C)C)/C)OC)C
Compound: 17-O-ethylnotoamide M
SMILES: O=C1N[C@H](C(=O)N2[C@@]1(OCC)CCC2)C[C@]3(C(=O)NC4=C3C=CC5=C4C=CC(O5)(C)C)C(C=C)(C)C
Compound: Kasanosin A
SMILES: O=C1C2=C(C=C(/C=C/CO)OC2)C[C@@H]([C@@]1(O)C)OC(=O)C3=C(O)C=C(OC)C=C3C
Compound: Shewanelline C
SMILES: O=C1N(C(=O)C=2C=CC=CC2N1)[C@H]3C(=O)NC4=C3C=CC=C4
Compound: Discoipyrrole B
SMILES: O=C1O[C@@]2(N(C(C3=CC=C(O)C=C3)=C(C2=O)C4=CC=CC=C4)C5=C1C=CC=C5)CC(C)C
Compound: Fusarester C
SMILES: O=C1C=C(OC(=C1)C(=C[C@H](C[C@H](CC)C)C)C)OC
Compound: 10-O-acetylsclerotiamide
SMILES: O=C1N2[C@@]3(C(=O)N[C@]14[C@@H](OC(=O)C)[C@@]5(C(=O)NC6=C5C=CC7=C6C=CC(O7)(C)C)C([C@@H]4C3=O)(C)C)CCC2
Compound: 10-hydroxy-5'-methoxy-6'-chloroarmillane
SMILES: ClC1=C(OC)C=C(O)C(=C1C)C(=O)O[C@H]2[C@]3(O)[C@]([C@H]4[C@@H](O)C(C)(C)C[C@H]4[C@@H]([C@H]3CO)O)(C)C2
Compound: Aspergillusene C
SMILES: O=C(O)C1=CC(O)=C(/C(=C/C[C@H](O)C(C)C)/C)C=C1
Compound: Paeciloquinone E
SMILES: O=C1C2=C(O)C3=C(O[C@]4(C)OC[C@H]3CC4)C=C2C(=O)C=5C1=C(O)C=C(O)C5
Compound: Fusarester D
SMILES: O=C1C=C(OC(=C1)C(=C[C@H](C[C@@H](CO)CC)C)C)OC
Compound: 10-O-ethylsclerotiamide
SMILES: O=C1N2[C@@]3(C(=O)N[C@]14[C@@H](OCC)[C@@]5(C(=O)NC6=C5C=CC7=C6C=CC(O7)(C)C)C([C@@H]4C3=O)(C)C)CCC2
Compound: Conioscleroderolide
SMILES: O=C1OC=2C=3C(=C(OCC=C(C)C)C=C(C3C1=O)O)C(C)=CC2O
Compound: 17-hydroxycitrinalin B
SMILES: O=[N+]([O-])[C@@]12[C@@H](C(C)(C)[C@]3(C1)C(=O)NC4=C3C=CC5=C4C(=O)CC(O5)(C)C)C[C@@H]6[C@H](O)CCN6C2
Compound: Gallicynoic acid D
SMILES: O=C(O)CCCCCCC/C=C\[C@H](O)C#C[C@H](O)CCCC
Compound: Fusarester E
SMILES: O=C1C(=C(OC(=C1C)C(=C/C(=C/[C@H](CC)C)/C)C)OC)C
Compound: 10-O-ethylnotoamide R
SMILES: O=C1N2[C@@]3(C(=O)N[C@]14[C@@H](OCC)C=5C6=C(C7=C(OC(C)(C)C=C7)C=C6)NC5C([C@@H]4C3)(C)C)CCC2
Compound: Phencomycin methyl ester
SMILES: O=C(OC)C=1C2=NC=3C(=C(C(=O)OC)C=CC3)N=C2C=CC1
Compound: Citrinalin C
SMILES: O=C1N[C@]23[C@@H](C(C)(C)[C@]4(C2)C(=O)NC5=C4C=CC6=C5C(=O)CC(O6)(C)C)C[C@]17N(CC[C@H]7O)C3
Compound: Cyanostatin B
SMILES: O=C(N[C@H](C(=O)O)CC1=CC=C(O)C=C1)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](O)[C@H](N)CCCCCCC)CC3=CC=C(O)C=C3)C)C(CC)C)CCC2
Compound: Sarocladione
SMILES: O=C1[C@H]2O[C@H](CCC(C)=CCC[C@]3([C@H]1CC[C@@H]3[C@@H](/C=C/[C@@H](C(C)C)C)C)C)CC(C2)=O
Compound: Modiolide D
SMILES: O=C1O[C@@H](C[C@H](O)C=C[C@H](C=C1)OC(=O)C)C
Compound: Terrestrol K
SMILES: ClC=1C(=O)[C@@H]([C@H](O)[C@H](C1)O)C
Compound: 6_,9_-dihydroxy-14-p-nitrobenzoylcinnamolide
SMILES: O=[N+]([O-])C1=CC=C(C(=O)OC[C@@]2([C@H]3[C@@]([C@]4(O)C(C(=O)OC4)=C[C@H]3O)(CCC2)C)C)C=C1
Compound: Penostatin D
SMILES: O1[C@H](C(=C[C@@H]2[C@@H]1[C@H](O)C=C3C[C@H](C[C@@H]23)O)C)/C=C/CCCCCCC
Compound: Modiolide E
SMILES: O=C1O[C@@H](C[C@H](OC(=O)C)C=C[C@H](C=C1)O)C
Compound: Clostrindolin
SMILES: O=C1OC(=C(O)C=C1C=2C3=C(C=CC=C3)NC2)C
Compound: BE-52440A
SMILES: S(C12C(=O)C3=C(C(O)=CC=C3)C([C@]1(O)[C@@H](O[C@H](C2)CC(=O)OC)C)=O)C45C(=O)C6=C(C(O)=CC=C6)C([C@]4(O)[C@@H](O[C@H](C5)CC(=O)OC)C)=O
Compound: Diaporine
SMILES: O=C1C2=C(O)C3=C(C(=O)[C@@]4(OC)[C@@]([C@@H]3O)(O4)[C@]56O[C@@]5(OC)C(=O)C=7C=C8OC(C)=CC(C8=C(C7[C@H]6O)O)=O)C=C2OC(=C1)C
Compound: Microsphaerophthalide D
SMILES: O=C1O[C@H](OCC)C=2C1=C(OC)C(=C(O)C2COC)C
Compound: Modiolide F
SMILES: O=C1O[C@H](C[C@@H](O)C=C[C@H](C=C1)OC(=O)C)C
Compound: Cycloheptamycin B
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC=O)C(C)C)C(=O)N[C@@H](C(=O)N[C@H](C)C(N([C@@H](C(N[C@H](C(N([C@H]1CC=2C3=C(C=CC(=C3)OC)NC2)C)=O)[C@@H](O)C)=O)[C@H](CC)C)C)=O)CC4=CC=C(OC)C=C4)C
Compound: Nostocyclamide M
SMILES: S1C2=NC(=C1)C(=O)N[C@H](C=3OC(C)=C(N3)C(=O)NCC4=NC(C(N[C@@H]2CCSC)=O)=CS4)C
Compound: Spiromastixone G
SMILES: ClC1=C2OC3=C(C=C(OC)C(=C3CCC)Cl)OC(C2=C(CCC)C(=C1O)Cl)=O
Compound: Kurahyne
SMILES: O=C(N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)N2[C@H](C(=O)CC)CCC2)CCC1)C(C)C)C)C(C)C)C)[C@H](CC)C)C)[C@H](CC)C)C)/C(=C/CCCC#C)/C
Compound: Curtachalasin O
SMILES: O=C1C2=C[C@H]3[C@@H]([C@@H](O)[C@](O)(C(=O)C)[C@H](C3)C)[C@H]([C@]24C(=O)N[C@H]([C@@H]4C(=C1C)C)CC5=CC=CC=C5)OC(=O)C
Compound: Modiolide G
SMILES: O=C1O[C@H](C[C@@H](O)C=C[C@H](C=C1)O)C
Compound: Amidepsine I
SMILES: O=C(OC1=CC(O)=C(C(=O)N[C@H](C(=O)O)C)C(=C1)C)C2=C(O[C@@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3OC(=O)C)O)CO)C=C(OC(=O)C4=C(O)C=C(OC)C=C4C)C=C2C
Compound: Tripropeptin B
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)CCCCCCCCC(C)C
Compound: 1-(2,5-dihydroxyphenyl)-3-hydroxybutan-1-one
SMILES: O=C(C1=C(O)C=CC(=C1)O)C[C@H](O)C
Compound: 7_-hydroxycholesterol-1_-carboxylic acid
SMILES: O=C(O)[C@H]1[C@]2(C(=C[C@H](O)[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4[C@@H](CCCC(C)C)C)C)C[C@H](C1)O)C
Compound: Curtachalasin P
SMILES: O=C1[C@](O)([C@H](OC(=O)C)[C@H]2[C@@H](O)[C@@]34C(=O)N[C@H]([C@@H]3C(C)=C([C@H]([C@@H]4CC2=C[C@@H]1C)O)C)CC5=CC=CC=C5)C
Compound: Emerixanthone A
SMILES: ClC([C@@H](O)CC1=C2OC3=C(C4=C(OC[C@@H]([C@H]4O)C(=C)C)C(=C3)C)C(C2=C(O)C=C1)=O)(C)C
Compound: Cinnabaramide D
SMILES: O=C1N[C@](C(=O)O)([C@@H](O)[C@@H]2C=CCCC2)[C@]([C@H]1C(O)CCCCC)(O)C
Compound: 1-(2,5-dihydroxyphenyl)-3-methoxy-butan-1-one
SMILES: O=C(C1=C(O)C=CC(=C1)O)C[C@H](OC)C
Compound: Curtachalasin F
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14[C@H](OC(=O)C)[C@@H]5[C@@H](O)[C@](O)(C(=O)C)[C@@H](C)C[C@H]5[C@@H]([C@H]4[C@H](O)[C@@]6(C)[C@@]3(O6)C)O
Compound: (10Z)-14-butan-2-yl-20-methoxy-2,8,12,15-tetrazatricyclo[15.4.0.04,8]henicosa-1(17),10,18,20-tetraene-3,9,13,16-tetrone
SMILES: O=C1NC(C(=O)NC=CC(=O)N2C(C(NC3=C1C=CC(=C3)OC)=O)CCC2)C(CC)C
Compound: Pentalenolactone B
SMILES: O=C1OC[C@H]2C(C(=O)O)=C[C@H]3[C@]2([C@]14OC4)CC(=C)[C@H]3C
Compound: 6,7-seco-Agroclavine
SMILES: N1C2=C3C(=CC=C2)[C@@H](C=C(C)C)[C@@H](CC3=C1)NC
Compound: Curtachalasin G
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@]14C(=C[C@@H]5C[C@H](C)[C@@]([C@@H]([C@H]5[C@H]4OC(=O)C)O)(O)C(=O)C)[C@H](O)C(=C)[C@H]3C
Compound: Kurahamide
SMILES: O=C/1N[C@@H]2C(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C(O[C@@H]([C@@H](C(N\C1=C/C)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCC)C)[C@H](OC(=O)[C@@H](NC(=O)CCC)C)C)C)=O)C(C)C)CC3=CC=C(O)C=C3)C)CC4=CC=CC=C4)[C@H](O)CC2
Compound: (-)-cis-carveol
SMILES: CC(=C)[C@@H]1CC=C(C)[C@H](O)C1
Compound: 7-Methoxypradimicinone II
SMILES: COc1cc(O)c2C(=O)c3c(OC)c4[C@H](O)[C@@H](O)c5cc(C)c(C(=O)NC(C)C(O)=O)c(O)c5-c4c(O)c3C(=O)c2c1
Compound: 2-[2-[[2-[[2-[[2-[[2-[2-[[5-(diaminomethylideneamino)-2-[[2-methyl-2-[[3-methyl-2-[2-[[2-methyl-2-[2-[[2-methyl-2-[[2-methyl-2-[[2-methyl-2-[[1-(2-methyl-3-oxotetradecanoyl)pyrrolidine-2-carbonyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]butanoyl]amino]propanoyl]amino]pentanoyl]amino]propanoylamino]-2-methylpropanoyl]amino]acetyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]propanoylamino]propanoic acid
SMILES: O=C(NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)C)C)(C)C)(C)C)(C)C)C)CCCNC(=N)N)(C)C)C(C)C)C)(C)C)C)(C)C)C(NC(=O)C(NC(=O)C1N(C(=O)C(C(=O)CCCCCCCCCCC)C)CCC1)(C)C)(C)C
Compound: Lobocyclamide C
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)[C@@H](O)C(C)C)=O)C)=O)[C@@H](O)C(C)C)=O)C(C)C)=O)CCCCC)[C@H](O)C)CC(C)C)C[C@H](C2)O)[C@H](O)C)[C@@H](O)CO)C(CC)C)C
Compound: Asperitaconic acid B
SMILES: O=C(O)C(=C)[C@@H](C(=O)O)CCCCCCOC(=O)C
Compound: Curtachalasin H
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14C(OC(=O)C)[C@H]5C(C[C@H](C)[C@@]([C@@H]5O)(O)C(=O)C)=C[C@H]4[C@@H](O)C(C)=C3C
Compound: Biselyngbyolide B
SMILES: O=C1O[C@@H](/C=C(\C/C=C/C)/C)CC=CC=CC[C@H](C)C=C([C@H](CC=C[C@H](C1)O)OC)C
Compound: Altemicidin
SMILES: S(=O)(=O)(N)CC(=O)N[C@]1(C(=O)O)[C@H]2[C@H](C(C(=O)N)=CN(C2)C)C[C@@H]1O
Compound: Amycomycin A
SMILES: O=C1C2=C(O)C(=CC=C2C(=O)C3=C1C=CC=C3O)CC(O)(C(O)C(=O)OC)C
Compound: Asperitaconic acid C
SMILES: O=C(O)C(=C)[C@@H](C(=O)O)CCCCC(=O)C
Compound: Curtachalasin I
SMILES: Cl[C@]1([C@@]2(O[C@@]3([C@@H]1O)C[C@@H]4C[C@H](C)[C@@]([C@@H]([C@H]4[C@H]([C@]53[C@@H]2[C@@H](NC5=O)CC6=CC=CC=C6)OC(=O)C)O)(O)C(=O)C)C)C
Compound: Pterulamide I
SMILES: S(=O)(/C=C/C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)NC)[C@H](CC)C)C)C(C)C)C(C)C)C)[C@H](CC)C)C)C)C)C
Compound: Verticinol B
SMILES: O=C(OC(C(O)(C)C)CCC([C@@H]1C=C[C@](O)(C)CC1)C)C
Compound: Dolyemycin A
SMILES: O=C1N2[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](O)C(=O)N[C@@H](C(=O)N[C@H]([C@@H](O)C(C)C)C(N[C@@H]([C@@H](C(N[C@H](C(N[C@H](C(NCC(N[C@H]1[C@@H](O)C3=CC=CC=C3)=O)=O)CC(=O)O)=O)C)=O)NC(=O)/C=C/C4=NC=CC=C4/C=C\C)C)=O)CC(C)C)CC=5C6=C(C=CC=C6)NC5)[C@@H](O)C7=CC=C(OC)C=C7)CCC2
Compound: Ganodernoid F
SMILES: O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3([C@H]1O)C)C(=CC(=O)CC(C(=O)OC)C)C)C)[C@@H](O)C[C@@H]4[C@@]2(CC[C@@H](C4(C)C)O)C
Compound: Curtachalasin J
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14[C@H](OC(=O)C)[C@@H]5[C@@H](O)[C@](O)(C(=O)C)[C@@H](C)C[C@H]5[C@@H]([C@H]4[C@H](O)C(C)=C3C)O
Compound: 3-methoxyaplysiatoxin
SMILES: BrC1=C(C=C(O)C=C1)[C@@H](OC)CC[C@@H]([C@H]2O[C@@]34O[C@](OC)([C@H](C)CC3(C)C)CC(=O)O[C@H](CC(O[C@H]([C@@H]2C)C4)=O)[C@H](O)C)C
Compound: Dolyemycin B
SMILES: O=C1N2[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](O)C(=O)N[C@@H](C(=O)N[C@H]([C@@H](O)C(C)C)C(N[C@@H]([C@@H](C(N[C@H](C(N[C@H](C(NCC(N[C@H]1[C@@H](O)C3=CC=CC=C3)=O)=O)C(C(=O)O)C)=O)C)=O)NC(=O)/C=C/C4=NC=CC=C4/C=C\C)C)=O)CC(C)C)CC=5C6=C(C=CC=C6)NC5)[C@@H](O)C7=CC=C(OC)C=C7)CCC2
Compound: 1-Cyclohexyldecane
SMILES: C1(CCCCC1)CCCCCCCCCC
Compound: Saquayamycin H
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=C6N)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: Curtachalasin K
SMILES: Cl[C@@H]1C2[C@@]3(C(=O)N[C@H]([C@@H]3C(C)=C([C@@H]2O)C)CC4=CC=CC=C4)[C@H](OC(=O)C)[C@H]5[C@H]1C[C@H](C)[C@@]([C@@H]5O)(O)C(=O)C
Compound: 3-methoxydebromoaplysiatoxin
SMILES: O=C1O[C@@H]([C@H](O)C)CC(=O)O[C@@H]2[C@H](C)[C@H](O[C@]3(O[C@](C1)(OC)[C@@H](CC3(C)C)C)C2)[C@H](CC[C@H](OC)C4=CC(O)=CC=C4)C
Compound: 4,8-dimethyl-6-hydroxyquinoline
SMILES: OC1=CC=2C(=NC=CC2C)C(=C1)C
Compound: Peniazaphilin A
SMILES: O=C1C2=C([C@@H](OC)C3(OCCC3)OC2)C[C@@H]([C@]1(O)C)O
Compound: 6-[(1'R,2'S)-dihydroxypentyl]-2H-pyran-2-one
SMILES: O=C1OC(=CC=C1)[C@H](O)[C@@H](O)CCC
Compound: Fasciculic acid F
SMILES: O=C(O[C@H]1[C@H](O)C([C@@H]2CCC3=C([C@]2(C1)C)C[C@H](O)[C@]4([C@]3(CC[C@@H]4[C@H](CO)CC[C@@H](O)C(O)(C)C)C)C)(C)C)CC(O)(CC(=O)O)C
Compound: Tryptoquivaline T
SMILES: O=C1N(C=NC2=C1C=CC=C2)[C@H]3C(=O)O[C@@]4(C3)C5=C(C=CC=C5)N6[C@H]4N(C=O)C(C)(C)C6=O
Compound: Curtachalasin L
SMILES: Cl[C@@H]1[C@H]2C=C(C(=C)[C@@H]3[C@]2(C(=O)N[C@H]3CC4=CC=CC=C4)[C@H](OC(=O)C)[C@H]5[C@H]1C[C@H](C)[C@@]([C@@H]5O)(O)C(=O)C)C
Compound: Quinomycin H1
SMILES: S1C(SC)[C@@H]2N(C(=O)[C@@H](NC(=O)[C@H](NC(=O)C3=NC=4C(=CC=CC4)C=C3O)COC([C@@H](N(C([C@H](C1)N(C(=O)[C@@H](NC(=O)[C@H](NC(=O)C5=NC=6C(=CC=CC6)N=C5)COC([C@@H](N(C2=O)C)C(C)C)=O)C)C)=O)C)C(C)C)=O)C)C
Compound: Vicibactin-7101
SMILES: O=C1O[C@@H](CC(=O)N(O)CCC[C@@H](N)C(=O)O[C@@H](CC(=O)N(O)CCC[C@H](C(O[C@@H](CC(N(CCC[C@H]1N)O)=O)C)=O)N)C)C
Compound: Sartorypyrone C
SMILES: O=C1OC(=CC(=C1CC2=C(CC[C@H]3[C@]2(CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C)O)C
Compound: Nocardiopsin C
SMILES: O=C1N2[C@H](C(=O)OC(C(O)CC(=O)CC)(CC(C3OC(CC3)CCC=C(C(C(CCC=C1)C)=O)C)C)C)CCC2
Compound: Curtachalasin M
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@]14C(C=C(C)C3=C)=C[C@@H]5C[C@H](C)[C@@]([C@@H]([C@H]5[C@H]4OC(=O)C)O)(O)C(=O)C
Compound: Quinomycin H2
SMILES: S1C(SC)[C@@H]2N(C(=O)[C@@H](NC(=O)[C@H](NC(=O)C3=NC=4C(=CC=CC4)N=C3)COC([C@@H](N(C([C@H](C1)N(C(=O)[C@@H](NC(=O)[C@H](NC(=O)C5=NC=6C(=CC=CC6)C=C5O)COC([C@@H](N(C2=O)C)C(C)C)=O)C)C)=O)C)C(C)C)=O)C)C
Compound: Mutaxanthene A
SMILES: O=C1C=2OC3C(=O)C(=C(O)C(C3(C(=O)O)CC2C(=O)C=4C1=C(O)C=CC4)OC)C(=O)CC
Compound: Penicimutalide A/B
SMILES: O=C(N[C@H](C(=O)NC(OCC)CC(C)C)CCC(=O)N)[C@@H](NC(=O)C[C@H](O)CCCCCCCCC)CC(=O)N
Compound: Neplanocin A
SMILES: O[C@@H]1C(=C[C@H]([C@@H]1O)N2C3=NC=NC(=C3N=C2)N)CO
Compound: Curtachalasin N
SMILES: O=C1C2=C[C@H]3[C@@H]([C@@H](O)[C@](O)(C(=O)C)[C@H](C3)C)[C@H]([C@]24C(=O)N[C@H]([C@@H]4C(=C1C)C)CC5=CC=CC=C5)O
Compound: Penicimutalide C/D
SMILES: O=C(N[C@H](C(=O)NC(OC)CC(C)C)CCC(=O)N)[C@@H](NC(=O)C[C@H](O)CCCCCCCCC)CC(=O)N
Compound: (S)-3,4-dihydro-3-(1H-indol-3-ylmethyl)-4-methyl-1H-1,4-benzodiazepine-2,5-dione
SMILES: O=C1N([C@H](C(=O)NC2=C1C=CC=C2)CC=3C4=C(C=CC=C4)NC3)C
Compound: Cyclo-(N-MeVal-N-MeAla)
SMILES: O=C1N([C@H](C(=O)N([C@H]1C(C)C)C)C)C
Compound: Emerone A
SMILES: O=C1[C@@]2(O)[C@](O)([C@H](C)[C@@H]3[C@@]([C@@H]1O)(OC4=C(C(=O)OC(=C4C)C)C3)C)CC(C2(C)C)=O
Compound: Persipeptide A
SMILES: O=C1N([C@H](C(=O)N[C@H](C(=O)N[C@H](C(N([C@H](C(N[C@H]1C(C)C)=O)C(C)C)C)=O)CC2=CC=CC=C2)C(C)C)CC3=CC=CC=C3)C
Compound: Emerone B
SMILES: O=C1OC(=C(C)C2=C1C[C@@H]3[C@H](CC[C@@]4(O)O[C@@H]([C@H]([C@]3(O2)C)O)C(=O)C4(C)C)C)C
Compound: Zopfiellamide B
SMILES: O=C1N(C(CC(O)(C(=O)O)C(CC)C)C(C1=C(O)/C=C/[C@@H]2[C@@H]3[C@@H](C=C[C@@H]2C)CCCC3)=O)C
Compound: Flavoroseoside B
SMILES: ClC1=C(O[C@H]2O[C@H](CO)[C@H]([C@H]2O)O)C=C(O)C3=C1C[C@@H](C)OC3=O
Compound: Penicimutalide E
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)N)CC(C)C)CCC(=O)N)[C@@H](NC(=O)C[C@H](O)CCCCCCCCC)CC(=O)N
Compound: LL-BM123 gamma1
SMILES: O=C1N(C(=O)N)[C@H]2[C@@H](OC[C@H]([C@@H]2N1)O)O[C@H]3[C@H](O)[C@@H](NC(=O)N)[C@@H](NC(=O)N[C@H]4[C@H](O)[C@@H](N=C(N)N)[C@@H](OC5=CC=C(/C=C/C(=O)NCCCNCCCCN)C=C5)O[C@@H]4C)OC3
Compound: Emerone C
SMILES: O=C1OC(=C(C)C2=C1C[C@@H]3[C@H]([C@](O)(C)O[C@@H]([C@]3(O2)C)C(O)C(=O)C(C)C)C)C
Compound: Xentrivalpeptide F
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)CCCC(C)C)C(C)C)C(=O)N[C@@H](C(=O)N2[C@@H](CCC2)C(N[C@H](C(N[C@H](C(N[C@H]1C(C)C)=O)C(C)C)=O)C(C)C)=O)CC3=CC=CC=C3)C
Compound: Flutimide
SMILES: O=C/1N(O)C(=O)C(CC(C)C)=N\C1=C/C(C)C
Compound: Penicimutalide F
SMILES: O=C(N[C@H](C(=O)N[C@@H](C(=O)N)CC(C)C)CCC(=O)N)[C@@H](NC(=O)C[C@H](O)CCCCCCCCC)CC(=O)N
Compound: 4-hydroxy-2-O-alpha-ribofuranosyl-5-methylacetophenone
SMILES: O=C(C1=C(O[C@H]2O[C@H](CO)[C@H]([C@H]2O)O)C=C(O)C(=C1)C)C
Compound: Sorbicillfuran A
SMILES: O=C1/C(=C(\O)/C=C/C=C/C)/[C@H]2[C@@](O)(C)C([C@@]1([C@H]3C[C@@](O)(CO)O[C@@H]23)C)=O
Compound: 4-((Z)-but-2-enoyloxy)-12,13-epoxy-16-hydroxytrichothec-9-ene
SMILES: O=C(O[C@H]1[C@@]2([C@@]3([C@@H](C=C(CO)CC3)O[C@H](C1)[C@]24OC4)C)C)/C=C\C
Compound: Cylindrofridin B
SMILES: ClC(CCCC[C@@H]([C@@H](O)C1=CC(O)=C([C@H](CCCC[C@@H]([C@@H](OC(=O)C)C2=CC(O)=CC(=C2)O)C)CCCC)C(=C1)O)C)CCCC
Compound: Gerronemin A
SMILES: OC1=C(O)C=CC=C1CCCCCCCCCCCCC2=C(O)C(O)=CC=C2
Compound: Penicimutalide G
SMILES: O=C(N[C@H](C(=O)N)CCC(=O)N)[C@@H](NC(=O)C[C@H](O)CCCCCCCCC)CC(=O)N
Compound: Sorbicillfuran B
SMILES: O=C1/C(=C(\O)/C=C/C=C/C)/[C@H]2[C@@](O)(C)C([C@@]1([C@H]3[C@H]4[C@@](OC=5C(=C(O)C(=C6C5[C@@H]4O[C@@H]([C@H]6C)C)C)C(=O)O)(CO)O[C@@H]23)C)=O
Compound: (2R,3R,2'S)-2-Hydroxymyxol 2'-fucoside
SMILES: O1[C@@H](O[C@@H](/C=C/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C[C@@H](O)[C@@H](C2(C)C)O)C)\C)\C)/C)/C)/C)C(O)(C)C)[C@@H](O)[C@H](O)[C@@H]([C@@H]1C)O
Compound: Cylindrofridin C
SMILES: ClC(CCCC[C@@H]([C@@H](OC(=O)C)C1=CC(O)=C([C@H](CCCC[C@@H]([C@@H](OC(=O)C)C2=CC(O)=CC(=C2)O)C)CCCC)C(=C1)O)C)CCCC
Compound: Barakacin
SMILES: S1C(=NC(=C1)C(C=2C3=C(C=CC=C3)NC2)C=4C5=C(C=CC=C5)NC4)C6=C(O)C=CC=C6
Compound: 12-epi-lyngbyatoxin A
SMILES: O=C1N[C@@H](CC2=CNC=3C2=C(N([C@@H]1C(C)C)C)C=CC3[C@@](C=C)(CCC=C(C)C)C)CO
Compound: Rhizophol A
SMILES: O=C(C1=C(C(OC([C@@H]2OC2)(C)C)=C(C)C=C1O)C(=O)CC)C3=C(O)C=CC=C3O
Compound: Daldinin E
SMILES: O=C1C=2C(=CC([C@@]1(OC(=O)C)C)=O)[C@@H](OC(=O)/C(=C/C=C/C)/C)[C@]3(O[C@H](CC[C@H]3O)C)OC2
Compound: 2-amino-3-hydroxy-4-methoxybenzoic acid methyl ester
SMILES: O=C(OC)C1=C(N)C(O)=C(OC)C=C1
Compound: Cylindrofridin A
SMILES: ClC(CCCC[C@@H]([C@@H](OC(=O)C)C1=CC(O)=CC(=C1)O)C)CCCC
Compound: Tubingenoic anhydride A
SMILES: O=C1OC(=O)[C@H](C1=C)CCCCCC
Compound: Poricoic acid BM
SMILES: O=C(O)C([C@@H]1[C@@]2([C@@](C=3C([C@]([C@H](C(=C)C)CC3)(CCC(=O)OC)C)=CC2)(C)C[C@H]1O)C)CCC=C(C)C
Compound: Rhizophol B
SMILES: O=C1C2=C(C(OC([C@@H]3OC3)(C)C)=C(C)C=C2OC4=C1C(O)=CC=C4)C(=O)CC
Compound: Limacellone
SMILES: O=C1C=C2[C@]3(OC4(O)C[C@@H](O3)O[C@]2(C4(C)C)C)C[C@H]1C
Compound: Higginsianin A
SMILES: O=C1OC(=C(C)C(=C1C[C@@H]2C(=C)CC[C@@H]3[C@@]2(CC[C@@]4([C@]3(C[C@@H](C=C(C)C)O4)C)C)C)O)C
Compound: 2-oxo-3(R)-hydroxy-lyngbyatoxin A
SMILES: O=C1N[C@@H](C[C@]2(O)C(=O)NC=3C2=C(N([C@H]1C(C)C)C)C=CC3[C@@](C=C)(CCC=C(C)C)C)CO
Compound: Preaspernidgulene A1
SMILES: O=C1O[C@@H](C(=CC=CC=CC(=CC(=CC(=CC(=O)O)C)C)C)C)[C@H](C)C(=C1C)O
Compound: 7-oxobrefeldin A
SMILES: O=C1O[C@H](CCCC=C[C@H]2[C@H]([C@@H](C=C1)O)CC(=O)C2)C
Compound: Cytospolide C
SMILES: O=C1O[C@@H]([C@@H](OC(=O)C)CCC=C[C@H]([C@H]1C)OC(=O)C)CCCCC
Compound: Higginsianin B
SMILES: O=C1OC(=C(C)C(=C1C[C@@H]2C(=C)CC[C@@H]3[C@@]2(CC[C@H]([C@]3(CCC=C(C)C)C)O)C)O)C
Compound: 2-oxo-3(R)-hydroxy-13-N-desmethyl-lyngbyatoxin A
SMILES: O=C1N[C@@H](C[C@]2(O)C(=O)NC=3C2=C(N[C@H]1C(C)C)C=CC3[C@@](C=C)(CCC=C(C)C)C)CO
Compound: Preaspernidgulene A2
SMILES: O=C1O[C@@H](C(=CC=CC=CC(=CC(=CC(=CC(=O)O)C)C)C)C)C(C)(C)C(=C1C)O
Compound: Hormothamnin A
SMILES: O=C/1N2[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H]([C@H](CC)C)C(N[C@H](C(NCC(N[C@@H](CC(N[C@H](C(N\C1=C/C)=O)CCO)=O)CCCCC)=O)=O)CC(C)C)=O)[C@H](CC)C)CC(C)C)CC3=CC=CC=C3)CCO)C[C@H](C2)O
Compound: Neohop-13(18)-ene
SMILES: C12=CC[C@@H]3[C@@]4([C@H](C(CCC4)(C)C)CC[C@]3([C@@]1(CC[C@]5([C@H]2CC[C@@H]5C(C)C)C)C)C)C
Compound: Nahuoic acid B
SMILES: O=C(O)/C(=C/[C@H]1[C@H](/C(=C/C[C@H](O)C[C@@H](O)[C@@H]([C@@H](O)C(C)C)C)/C)C=C[C@]2([C@@H]1[C@H]([C@H](O)[C@@H]([C@H]2O)O)C)C)/C
Compound: Heronapyrrole D
SMILES: O=[N+]([O-])C=1NC=C(C1)C/C=C(/CC[C@H](O)[C@@]2(O[C@@H](C(O)(C)C)CC2)C)\C
Compound: Cymbimicin A
SMILES: O=C1OC(C2=CC=CC=C2)C(C1NC(=O)C(NC(=O)C(C(OC)CC(O)/C(=C/CC(O)C(C(O)C(/C=C/C=C/C3OC(OC)(CC(C3)OC)CC/C(=C/C=C/C4C(O)C(O)(C(C)OC4)C)/C)C)CC)/C)C)C(C)C)C
Compound: Aspernidgulene A1
SMILES: O=C1O[C@@H]([C@H](C(=O)O)C)[C@@]([C@H]1C)(C=CC=CC=C([C@H]2[C@@H](C(=O)[C@@]([C@@H]2C)(O)C)C)C)C
Compound: YM-51084
SMILES: O=C(N[C@@H](C=O)CC1=CC=CC=C1)[C@@H](NC(=O)[C@H](NC(=O)CC(C)C)CC2=CC=C(O)C=C2)C(C)C
Compound: Nahuoic acid C
SMILES: O=C(O)/C(=C/[C@H]1[C@H](/C(=C/C[C@H](O)C[C@@H](O)[C@@H]([C@@H](O)C(C)C)C)/C)C=C[C@]2([C@@H]1[C@H](CC[C@H]2O)C)C)/C
Compound: Cyclo(D -Pro-L -Tyr-L -Pro-L -Tyr)
SMILES: O=C1N2[C@H](C(=O)N[C@H](C(=O)N3[C@@H](C(N[C@H]1CC4=CC=C(O)C=C4)=O)CCC3)CC5=CC=C(O)C=C5)CCC2
Compound: Cyanopeptolin 972
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)CCCCC)CC(=O)O)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC(C)C)C2=O)O)CCCN=C(N)N)C
Compound: Aspernidgulene A2
SMILES: O=C1O[C@@H]([C@H](C(=O)O)C)[C@@]([C@H]1C)(C=CC=CC=C([C@H]2[C@@H](C(=O)[C@]([C@@H]2C)(O)C)C)C)C
Compound: Nahuoic acid D
SMILES: O=C(O)/C(=C/[C@H]1[C@H](/C(=C/C[C@H](O)C[C@@H](O)C[C@@H](O)[C@@H]([C@@H](O)C(C)C)C)/C)C=C[C@]2([C@@H]1[C@H](CC[C@H]2O)C)C)/C
Compound: 11-oxo-12_-acetoxy-4,4-dimethyl-24-methylene-5_-cholesta-8,14-diene-2_,3_-diol
SMILES: O=C1C2=C(C3=CC[C@@H]([C@]3([C@H]1OC(=O)C)C)[C@@H](CCC(=C)C(C)C)C)CC[C@@H]4[C@@]2(C[C@@H](O)[C@@H](C4(C)C)O)C
Compound: Jiangrine D
SMILES: O=CC=1N(C([C@H](OC)[C@H](O)CO)=CC1)CCC2=CC=C(O)C=C2
Compound: Cephalosol
SMILES: O=C1OC=2C(=O)O[C@](C2C=3C1=C(O)C=C(OC)C3)(CC(=O)OC)C
Compound: Aspernidgulene B1
SMILES: O=C1O[C@@H]([C@H](C(=O)O)C)[C@@]([C@H]1C)(C=CC=CC=C(C=C(C(=O)C(CC)C)C)C)C
Compound: Nahuoic acid E
SMILES: O=C(O)/C(=C/[C@H]1[C@H](/C(=C/C[C@H](O)C[C@@H](O)C[C@@H](O)[C@@H]([C@@H](O)C(C)C)C)/C)C=C[C@]2([C@@H]1[C@H]([C@H](O)C[C@H]2O)C)C)/C
Compound: Isororidin P
SMILES: O=C1OCC23[C@@]4([C@@]5(OC5)[C@H](OC2C=C(C)CC3)C[C@H]4OC(=O)C=CC=C[C@@H]([C@@H](OCCC(=C1)C)C)O)C
Compound: Gymnopilin B11
SMILES: O=C(OC[C@@H](O)C(O)(CC/C=C(/CCCC(O)(CCCC(O)(CCCC(O)(CCCC(O)(CCCC(O)(CCCC(O)(CCCC(O)(CCCC(O)(CCC=C(C)C)C)C)C)C)C)C)C)C)\C)C)CC(O)(CC(=O)O)C
Compound: Aspernidgulene B2
SMILES: O=C1O[C@@H]([C@H](C(=O)O)C)[C@@]([C@H]1C)(C=CC=CC=C(C=C(C(O)C(=CC)C)C)C)C
Compound: Penicilfuranone A
SMILES: O=C1C2=C(C(O)=C(O)C(=C2)OC)[C@](O)(C)[C@H]([C@H]1C)C=3O[C@@](/C=C/C=C/CC)(C)C(C3C(=O)OC)=O
Compound: Solanopyrone B
SMILES: O=C1OC(=CC(=C1CO)OC)[C@@H]2[C@@H]3[C@H](C=C[C@H]2C)CCCC3
Compound: 7-Methyl-2-hydroxy-6-oxoocta-2,4-dienoate
SMILES: CC(C)C(=O)\C=C\C=C(/O)C(O)=O
Compound: Iso-naseseazine B
SMILES: O=C1N2[C@H](C(=O)N[C@H]1CC=3C4=C(C=C([C@]56C7=C(C=CC=C7)N[C@H]5N8C(=O)[C@@H]9CCCN9C([C@@H]8C6)=O)C=C4)NC3)CCC2
Compound: Scytodecamide
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)C(C)C)CC(C)C)CO)C)CC(C)C)CC(C)C)C)[C@H]1N(C(=O)[C@@H](NC(=O)[C@@H](NC)[C@H](CC)C)CO)CCC1
Compound: Nocarbenzoxazole B
SMILES: O1C(=NC2=C1C=CC(=C2)CO)C3=CC(N)=C(O)C=C3
Compound: (24E)-7alpha-acetoxy-15alpha-hydroxy-3-oxolanosta-8,24-dien-26-oic acid
SMILES: O=C1C([C@H]2[C@](C3=C([C@]4([C@]([C@@H]([C@@H](CC/C=C(/C(=O)O)\C)C)C[C@@H]4O)(C)CC3)C)[C@@H](C2)OC(=O)C)(C)CC1)(C)C
Compound: Cryptophycin A
SMILES: ClC1=C(OC)C=CC(=C1)C[C@@H]2NC(=O)C=CC[C@H](OC(=O)[C@@H](OC([C@@H](CNC2=O)C)=O)CC(C)C)[C@@H]([C@H]3O[C@@H]3C4=CC=CC=C4)C
Compound: Hydroisoflavone A
SMILES: O=C1C2=C(OC=C1C3=CCCC(C3O)O)C=C(O)C=C2O
Compound: N-isopentyltridecanamide
SMILES: O=C(NCCC(C)C)CCCCCCCCCCCC
Compound: Phototemtide A
SMILES: O=C1O[C@@H](CC(=O)NCC(=O)N[C@@H](C(C)C)C(N[C@@H](C(N[C@H](C(N[C@H]1[C@H](CC)C)=O)[C@H](O)C)=O)CC2=CC=CC=C2)=O)CCCCC
Compound: (24E)-7alpha-methoxy-3-oxolanosta-8,24-dien-26-oic acid
SMILES: O=C1C([C@H]2[C@](C3=C([C@]4([C@]([C@@H]([C@@H](CC/C=C(/C(=O)O)\C)C)CC4)(C)CC3)C)[C@@H](C2)OC)(C)CC1)(C)C
Compound: Talaromycesone A
SMILES: O=C1OC(O)=C2C[C@@H]3C45C=6C(C(=O)OC4)=C(O)C=C(C6C([C@H]([C@@]3(C=7C2=C1C(O)=CC7C)OC)[C@H]5OC(=O)C)=O)C
Compound: Penicimutanolone
SMILES: O=C(N[C@@H]1C(OC2(C1)[C@H]3O[C@H]3C(O)(CC(=O)C)[C@@H]4[C@H]2O4)O)/C=C\C(CC(CCCCCC)C)C
Compound: Marinisporolide B
SMILES: O=C1O[C@H]([C@H]([C@@H](O)C[C@@H](O)C[C@H](O)C[C@H](O)CC=C[C@H](O)C[C@@H](O)C[C@@]2(O[C@H](CC=CC=CC=CC=CC=C1C)C[C@H](O)C2)O)C)C(C)C
Compound: Phototemtide B
SMILES: O=C1O[C@@H](CC(=O)NCC(=O)N[C@@H](C(C)C)C(N[C@@H](C(N[C@H](C(N[C@H]1[C@H](CC)C)=O)[C@H](O)C)=O)CC2=CC=CC=C2)=O)CCC
Compound: (22S,24E)-3beta,22-diacetoxy-7alpha-methoxylanosta-8,24-dien-26-oic acid
SMILES: O=C(O)/C(=C/C[C@H](OC(=O)C)[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)C[C@H]3OC)C)CC2)(C)CC1)C)C)/C
Compound: Panglimycin F
SMILES: O=C1C2=C(C(O)=CC=C2)[C@@H](O)C34C1(O3)C5(O)C(=O)C[C@H](C)CC5(O)CC4
Compound: Talaromycesone B
SMILES: O=C1OCC23C=4C(O)=C5OC(=O)C6=C5C(C4[C@H]([C@H]2OC(=O)C)C(C7=C3C1=C(O)C=C7C)=O)=C(C=C6O)C
Compound: Trichopyrone
SMILES: O=C1OC(=CC(=C1C)O)/C=C/C=C/C
Compound: (22S,24E)-3beta,22-7alpha-methoxy-3beta,15alpha,22-triacetoxylanosta-8,24-dien-26-oic acid
SMILES: O=C(O)/C(=C/C[C@H](OC(=O)C)[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)C[C@H]3OC)C)CC2)(C)[C@H](C1)OC(=O)C)C)C)/C
Compound: Phototemtide C
SMILES: O=C1O[C@@H](CC(=O)NCC(=O)N[C@@H](C(C)C)C(N[C@@H](C(N[C@H](C(N[C@H]1[C@H](CC)C)=O)[C@H](O)C)=O)CC2=CC=CC=C2)=O)CCCC
Compound: Trichodone B
SMILES: O=C1C(=CC[C@@H](C1)[C@@H](CC[C@H](O)C(O)(C)C)C)C
Compound: Talaroxanthenone
SMILES: O=C1C2=C(O)C(=CC=C2OC3=C1C(=CC(=C3)C)CO)CC=C(C)C
Compound: Botryosphaeridione
SMILES: O=C1C(O)=C[C@]2([C@H](C(=O)C=CC2=C1)C)C
Compound: Phototemtide D
SMILES: O=C1O[C@@H](CC(=O)NCC(=O)N[C@@H](C(C)C)C(N[C@@H](C(N[C@H](C(N[C@H]1[C@H](CC)C)=O)[C@H](O)C)=O)CC2=CC=CC=C2)=O)CCCCCC
Compound: (24E)-3beta-acetoxy-15alpha-hydroxy-7alpha-methoxylanosta-8,24-dien-26-oic acid
SMILES: O=C(O)/C(=C/CC[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)C[C@H]3OC)C)CC2)(C)[C@H](C1)O)C)C)/C
Compound: Spiculisporic acid F
SMILES: O=C1O[C@](C(=O)O)([C@@H](C(=O)O)CCCCCCCCCC=C)CC1
Compound: (2R)-N-{(1S,2R,3E,7E)-1-[(beta-D-glucopyranosyloxy)methyl]-2-hydroxy-8-methylhexadeca-3,7-dien-1-yl}-2-hydroxyoctadecanamide
SMILES: O=C(N[C@H]([C@H](O)/C=C/CC/C=C(/CCCCCCCC)\C)CO[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@H]1O)O)CO)[C@H](O)CCCCCCCCCCCCCCCC
Compound: Cystochromone D
SMILES: O=C1C2=C(OC(=C1)CC(O)C)C=C(O)C=C2CCCCCCC(=O)C(O)CCCCCC(O)(C)C
Compound: Acyclolaxaphycin A
SMILES: O=C(N1[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)NCC(=O)O)CC(C)C)[C@H](CC)C)[C@H](CC)C)CC(C)C)CC2=CC=CC=C2)CCO)C[C@H](C1)O)/C(/NC(=O)[C@@H](NC(=O)C[C@H](N)CCCCC)CCO)=C\C
Compound: (24E)-3beta-acetoxylanosta-7,9(11),24-trien-26-oic acid
SMILES: O=C(O)/C(=C/CC[C@H]([C@@H]1[C@@]2([C@@](C=3C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)CC3)C)=CC2)(C)CC1)C)C)/C
Compound: Spiculisporic acid G
SMILES: O=C1O[C@](C(=O)O)([C@@H](C(=O)O)CCCCCCCCC)CC1
Compound: Kanamienamide
SMILES: O=C1O[C@H](CC[C@H](C)C[C@H](C(N([C@H]1CC(C)C)C)=O)C)CCC/C=C\N(C(=O)/C=C(/OC)\CC)C
Compound: Brunnein C
SMILES: O=C(O)[C@H]1NCC=2NC3=C(C2C1)C=CC(=C3)O
Compound: [des-Gly11]acyclolaxaphycin A
SMILES: O=C(O)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]1N(C(=O)/C(/NC(=O)[C@@H](NC(=O)C[C@H](N)CCCCC)CCO)=C\C)C[C@@H](C1)O)CCO)CC2=CC=CC=C2)CC(C)C)[C@H](CC)C)[C@H](CC)C)CC(C)C
Compound: 5-(4′,6′-dihydroxy-6′-methyloctyl)furan-2(5H)-one
SMILES: O=C1OC(CCCC(O)CC(O)(CC)C)C=C1
Compound: (22S,24E)-3beta,22-diacetoxylanosta-7,9(11),24-trien-26-oic acid
SMILES: O=C(O)/C(=C/C[C@H](OC(=O)C)[C@H]([C@@H]1[C@@]2([C@@](C=3C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)CC3)C)=CC2)(C)CC1)C)C)/C
Compound: Campechic acid B
SMILES: O=C(O)[C@H](C[C@H](C[C@@H](C[C@@H](C(=O)C=C(O)[C@@H](C[C@@H](CC=C[C@@H]([C@@H](O)CC1OC(C2OC([C@H](O)C)(C)CC2)(C)CC1)C)C)C)C)C)C)C
Compound: [des-(Leu10-Gly11)]acyclolaxaphycin A
SMILES: O=C(N1[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)NC[C@@H](C(=O)O)[C@H](CC)C)CC(C)C)[C@H](CC)C)[C@H](CC)C)CC(C)C)CC2=CC=CC=C2)CCO)C[C@H](C1)O)/C(/NC(=O)[C@@H](NC(=O)C[C@H](N)CCCCC)CCO)=C\C
Compound: Alcalinaphenol D
SMILES: BrC1=C(OC)C(O)=C(O)C=C1C
Compound: Ieodoglucomide C
SMILES: O=C(O)[C@@H](NC(=O)CCCCCCCCCCCC[C@H](O[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@H]1O)O)COC(=O)CCC(=O)O)CC)C
Compound: (22S,24E)-22-acetoxy-3beta-hydroxylanosta-7,9(11),24-trien-26-oic acid
SMILES: O=C(O)/C(=C/C[C@H](OC(=O)C)[C@H]([C@@H]1[C@@]2([C@@](C=3C([C@@]4([C@H](C([C@@H](O)CC4)(C)C)CC3)C)=CC2)(C)CC1)C)C)/C
Compound: Brialmontin 2
SMILES: O=C(OC1=C(C(OC)=CC(=C1C)C)C)C2=C(O)C(=C(OC)C(=C2C)C)C
Compound: [L-Val8]laxaphycin A
SMILES: O=C/1N2[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(C)C)C(N[C@H](C(NCC(N[C@@H](CC(N[C@H](C(N\C1=C\C)=O)CCO)=O)CCCCC)=O)=O)CC(C)C)=O)[C@H](CC)C)CC(C)C)CC3=CC=CC=C3)CCO)C[C@H](C2)O
Compound: Pimprinol B
SMILES: O1C(C=2C3=C(C=CC=C3)NC2)=CN=C1CC(O)(C)C
Compound: (22S,24E)-22-acetoxy-3,7-dioxolanosta-8,24-dien-26-oic acid
SMILES: O=C1C2=C([C@]3(CCC(C([C@@H]3C1)(C)C)=O)C)CC[C@]4([C@]2(CC[C@@H]4[C@@H]([C@@H](OC(=O)C)C/C=C(/C(=O)O)\C)C)C)C
Compound: Ieodoglycolipid
SMILES: O=C(OCC(O)CO[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@H]1O)O)CO[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)CCCCCCCCCCCCCC
Compound: Tyromycic acid D
SMILES: O=C1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@@H](CC/C=C(\C(=O)O)/C)C)CC4)(C)[C@@H](C3)O)C)=CC2)(C)CC1)(C)C
Compound: Pukeleimide B
SMILES: O=C1N(/C(=C\C(=O)N2C(=O)C=C(C2)OC)/C=C1OC)C
Compound: [D-Val9]laxaphycin A
SMILES: O=C/1N2[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(C)C)C(N[C@H](C(NCC(N[C@@H](CC(N[C@H](C(N\C1=C\C)=O)CCO)=O)CCCCC)=O)=O)CC(CC)C)=O)C(C)C)CC(C)C)CC3=CC=CC=C3)CCO)C[C@H](C2)O
Compound: (22S,24E)-3alpha,22-diacetoxy-7-oxolanosta-8,24-dien-26-oic acid
SMILES: O=C1C2=C([C@]3(CC[C@H](C([C@@H]3C1)(C)C)OC(=O)C)C)CC[C@]4([C@]2(CC[C@@H]4[C@@H]([C@@H](OC(=O)C)C/C=C(/C(=O)O)\C)C)C)C
Compound: 2alpha-hydroxyxylaranol B
SMILES: O[C@]1([C@@H]2[C@@H]([C@H](C)C[C@@H]2O)C[C@H](CC1)C(O)(CO)C)C
Compound: Neolymphostin D
SMILES: O=C(C=1NC=2C(NC(=O)CC(C)C)=CC(=N)C=3C2C(C1)=CN3)C=COC
Compound: (1S,3S)-austrocortilutein 8-O-beta-D-gentiobioside
SMILES: O=C1C2=C(O[C@@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)O)CO[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO)C=C(OC)C=C2C(=O)C5=C1[C@@H](O)C[C@](C5)(O)C
Compound: (22S,24E)-15alpha,22-diacetoxy-3-oxolanosta-8,24-dien-26-oic acid
SMILES: O=C1C([C@H]2[C@](C3=C([C@]4([C@]([C@@H]([C@@H]([C@@H](OC(=O)C)C/C=C(/C(=O)O)\C)C)C[C@@H]4OC(=O)C)(C)CC3)C)CC2)(C)CC1)(C)C
Compound: 4beta-hydroxyxylaranol B
SMILES: O[C@]1([C@@H]2[C@@H]([C@](O)(C)CC2)C[C@H](CC1)C(O)(CO)C)C
Compound: Clonostalactam
SMILES: O=C1N[C@@H](C)[C@@H]([C@]1(O)C(=O)CCC=CCCC)O
Compound: Laetiposide E
SMILES: O=C(O)[C@@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4(C(C([C@@H](O)CC4)(C)C)C[C@H]3OC5OCC(O)C(C5O)O)C)CC2)(C)CC1)C)CCC(=C)C(C)C
Compound: Penipyrol A
SMILES: O=C1OC(=CC=C1C)/C=C/C(=C/[C@H](C(=O)O)CC)/C
Compound: 6'''-dechloro-6'''-bromoclostomicin D
SMILES: BrC1=C(O)C(Cl)=C(O)C(=C1CC)C(=O)O[C@@H]2[C@@H](O)[C@@H](OC)[C@@H](OCC=3C(=O)OC(C(=O)C)CC=C(C=C(C(O[C@@H]4OC([C@@H](OC(=O)C(C)C)[C@@H]([C@@H]4O)O)(C)C)C(C=C(C(CC=CC3)O)C)CC)C)C)O[C@H]2C
Compound: (22S,24E)-3beta,15alpha,22-triacetoxylanosta-8,24-dien-26-oic acid
SMILES: O=C(O)/C(=C/C[C@H](OC(=O)C)[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)CC3)C)CC2)(C)[C@H](C1)OC(=O)C)C)C)/C
Compound: (3R,6R,9S,12R,15R)-12-[(2S)-butan-2-yl]-3-(1H-indol-3-ylmethyl)-15-(2-methylpropyl)-6,9-di(propan-2-yl)-1,4,7,10,13,16,19-heptazacyclodocosane-2,5,8,11,14,17,20-heptone
SMILES: O=C1N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)NCCC(NCC(N[C@@H](C(N[C@@H]1[C@H](CC)C)=O)CC(C)C)=O)=O)CC=2C3=C(C=CC=C3)NC2)C(C)C)C(C)C
Compound: 25-hydroxyporicoic acid H
SMILES: O=C(O)C([C@@H]1[C@@]2([C@@](C3=C([C@]([C@H](C(=C)C)CC3)(CCC(=O)O)C)CC2)(C)C[C@H]1O)C)CCC(=C)C(O)(C)C
Compound: (22S,24E)-15alpha,22-diacetoxy-3beta-hydroxylanosta-8,24-dien-26-oic acid
SMILES: O=C(O)/C(=C/C[C@H](OC(=O)C)[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](O)CC4)(C)C)CC3)C)CC2)(C)[C@H](C1)OC(=O)C)C)C)/C
Compound: (3R,6R,9S,12R,15R)-3-(1H-indol-3-ylmethyl)-15-(2-methylpropyl)-6,9,12-tri(propan-2-yl)-1,4,7,10,13,16,19-heptazacyclodocosane-2,5,8,11,14,17,20-heptone
SMILES: O=C1N[C@@H](C(=O)N[C@@H](C(=O)NCCC(=O)NCC(N[C@@H](C(N[C@@H](C(N[C@H]1C(C)C)=O)C(C)C)=O)CC(C)C)=O)CC=2C3=C(C=CC=C3)NC2)C(C)C
Compound: Penipyrol B
SMILES: O=C1OC(C2=CC(=C(OC(=O)C)C(=C2)C)CC)=CC=C1C
Compound: Aphthosin
SMILES: O=C(OC1=CC(O)=C(C(=O)OC2=CC(O)=C(C(=O)OC)C(=C2)C)C(=C1)C)C3=C(O)C=C(OC(=O)C4=C(O)C=C(OC)C=C4C)C=C3C
Compound: Trans-Ruakuric acid
SMILES: O=C(O)[C@@H]1OC2=C(C(O)=C(C(=O)C)C=C2)[C@H](C1)OC
Compound: (24E)-3beta-acetoxy-7alpha-hydroxylanosta-8,24-dien-26-oic acid
SMILES: O=C(O)/C(=C/CC[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)C[C@H]3O)C)CC2)(C)CC1)C)C)/C
Compound: (3S,6S,12S,15S)-12-[(2R)-butan-2-yl]-9-[(2S)-butan-2-yl]-3-(1H-indol-3-ylmethyl)-15-(2-methylpropyl)-6-propan-2-yl-1,4,7,10,13,16,19-heptazacyclodocosane-2,5,8,11,14,17,20-heptone
SMILES: O=C1NC(C(=O)N[C@H](C(=O)N[C@H](C(=O)NCCC(NCC(N[C@H](C(N[C@H]1[C@@H](CC)C)=O)CC(C)C)=O)=O)CC=2C3=C(C=CC=C3)NC2)C(C)C)[C@H](CC)C
Compound: Microsphaerophthalide A
SMILES: O=C1OCC=2C1=C(OC)C(=C(O)C2COCC)C
Compound: Peniamidone A
SMILES: O=C(NCCCCO)C1=CC(O)=C(O)C=C1
Compound: Rubetaujaponol B
SMILES: O=C(O[C@@H]1C(=C2[C@@](CC2)(C)[C@@H]3[C@@]1(O)C[C@@](CO)(C)C3)C)C
Compound: (24E)-3beta,15alpha-diacetoxy-7alpha-hydroxylanosta-8,24-dien-26-oic acid
SMILES: O=C(O)/C(=C/CC[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)C[C@H]3O)C)CC2)(C)[C@H](C1)OC(=O)C)C)C)/C
Compound: Wentixanthone A
SMILES: O=C1C2=C(OC3=C1C(C(=O)OC)=CC(=C3C(=O)OC[C@@H](O)CO)C)C=C(O)C=C2O
Compound: Peniamidone B
SMILES: O=C(NCCCCOC(=O)C)C1=CC(O)=C(O)C=C1
Compound: Cytochalasin Z14
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@]1(O)[C@@H](/C=C/C[C@@H]([C@H](O)C(=O)C)C)[C@H](O)C(C)=C3C
Compound: Emmyguyacin B
SMILES: O=C(OC(CCCC(=O)O[C@@H]1[C@@H](O)[C@H](O[C@@H]([C@H]1O)CO)O[C@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)CCCCC)C(=O)O
Compound: Peniamidone C
SMILES: O=C(NCCCO)C1=CC(O)=C(O)C=C1
Compound: Lahorenoic acid B
SMILES: O=C(OC)CCCCCC1=C(C=CC=C1)/C=C/C(=O)C
Compound: Wentiphenone A
SMILES: O=C(OC[C@@H](O)CO)C1=C(OC)C(=C(C(=O)OC)C=C1C)C(=O)C2=C(O)C=C(O)C=C2O
Compound: (22S,24E)-7alpha-hydroxy-3beta,15alpha,22-triacetoxylanosta-8,24-dien-26-oic acid
SMILES: O=C(O)/C(=C/C[C@H](OC(=O)C)[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](OC(=O)C)CC4)(C)C)C[C@H]3O)C)CC2)(C)[C@H](C1)OC(=O)C)C)C)/C
Compound: 6-Methoxy-8<6'-hydroxy-2'-methoxy-4'(3''-methyl-2''-butenyl)phenyl>2,2-dimethylchromene
SMILES: O1C2=C(C3=C(OC)C=C(CC=C(C)C)C=C3O)C=C(OC)C=C2C=CC1(C)C
Compound: Isariotin E
SMILES: O=C1C=C[C@H]2[C@@H]([C@]13O[C@@H](O)[C@H](C3)NC(=O)C=CCCCCCCCCC)O2
Compound: Xiamycin E
SMILES: O=C1C2=C(C=C3C=4C=CC=CC4NC3=C2)[C@]5(CC[C@@H]([C@]([C@@H]5C1)(C(=O)OC)C)O)C
Compound: Wentibianthrone B
SMILES: O=C1C2=C(O)C(=C(C)C=C2C(C3C4=C(C(=O)C5=C3C=C(C)C=C5O)C(OC)=CC(=C4)OC)C=6C1=C(O)C=C(O)C6)C(=O)OC[C@@H](O)CO
Compound: Peniamidone D
SMILES: O=C(NCCCC(=O)O)C1=CC(O)=C(O)C=C1
Compound: Penicillenol A2
SMILES: O=C/1N([C@H](C(O)C)C(\C1=C(\O)/C(CCCCCC)C)=O)C
Compound: Peniciherqueinone
SMILES: O=C1C(O)=C(C2=C3O[C@H](C)C(C3(O)C(C4=C2C1=C(O)C(OC)=C4)=O)(C)C)C
Compound: Xiamycin D
SMILES: O=C(OC)[C@@]1([C@@H](O)CC[C@]2([C@H]1C[C@H](O)C3=C2C=C4C5=C(C=CC=C5)NC4=C3)C)C
Compound: Dihydrocarneamide A
SMILES: O=C1N2[C@H](C(=O)N[C@H]1CC=3C4=C(C=C5OC(C)(C)C=CC5=C4)NC3C(C=C)(C)C)CCC2
Compound: (10S,10'S)-wentibianthrone A
SMILES: O=C1C2=C(O)C(=C(C)C=C2[C@H]([C@@H]3C4=C(C(=O)C5=C3C=C(C)C=C5O)C(O)=CC(=C4)OC)C=6C1=C(O)C=C(O)C6)C(=O)OC[C@@H](O)CO
Compound: Antalid
SMILES: S1C2=NC(=C1)C(=O)N[C@@H](C(=O)O[C@@H]([C@@H](C=C(C(N[C@H]2C(C)C)=O)C)C)C[C@@H](O)CC)CC3=CC=CC=C3
Compound: Pochonin N
SMILES: ClC1=C(O)C=C(O)C2=C1CC(=O)CC[C@@H](O)C=C[C@@H](C[C@H](OC2=O)C)O
Compound: Xiamycin C
SMILES: O=C(O)[C@@]1([C@@H](O)CC[C@]2([C@H]1C[C@H](O)C3=C2C=C4C5=C(C=CC=C5)NC4=C3)C)C
Compound: (10S,10'R)-wentibianthrone A
SMILES: O=C1C2=C(O)C(=C(C)C=C2[C@@H]([C@@H]3C4=C(C(=O)C5=C3C=C(C)C=C5O)C(O)=CC(=C4)OC)C=6C1=C(O)C=C(O)C6)C(=O)OC[C@@H](O)CO
Compound: Pyranonigrin F
SMILES: O=C1C(O)=C(OC2=C1C(=O)N[C@@H]2O)/C=C/CCC
Compound: Cyclipostin C
SMILES: [P@]1(=O)(OC(=C2C(=O)OC[C@@H]2CO1)C)OCCCCCCCCCCCCCC(O)CC
Compound: Polycarcin V
SMILES: O=C1OC=2C=3C(C(OC)=CC2C4=C1C=C(C=C)C=C4OC)=C(O)C=CC3[C@@H]5O[C@H]([C@H](O)[C@H]([C@H]5O)O)C
Compound: Retimycin A
SMILES: S(=O)(C1SCC2N(C(=O)C(NC(=O)[C@@H]([C@H](OC(C3(N(C(C1N(C(=O)C(NC(=O)[C@H](NC(=O)C4=NC=5C(=CC=CC5)C=C4O)[C@@H](C)OC(C6(N(C2=O)C)C(C)C6)=O)C)C)=O)C)C(C)C3)=O)C)NC(=O)C7=NC=8C(=CC=CC8)C=C7O)C)C)C
Compound: Ochraceopone A
SMILES: O=C1OC(=C(C)C2=C1[C@H](OC)[C@@H]3[C@H]([C@]4(O)CC(=O)C(C([C@]4([C@H]([C@]3(O2)C)O)O)=O)(C)C)C)C
Compound: Bacitracin E
SMILES: S1C(=N[C@@H](C1)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)NCCCC[C@@H]2NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC([C@H](NC([C@@H](NC([C@H](NC2=O)CCCN)=O)C(C)C)=O)CC3=CC=CC=C3)=O)CC=4NC=NC4)CC(=O)O)CC(=O)N)C(C)C)CCC(=O)O)CC(C)C)[C@@H](N)C(C)C
Compound: (10R,10′S)-wentibianthrone C
SMILES: O=C1C2=C(OC)C=C(OC)C=C2[C@H]([C@@H]3C4=C(C(=O)C5=C3C=C(C)C=C5O)C(OC)=CC(=C4)O)C=6C1=C(O)C=C(C)C6
Compound: Pterulone
SMILES: Cl/C=C/1\C=CC=2C=C(C(=O)C)C=CC2OC1
Compound: Butyl homononactate
SMILES: O=C(OCCCC)[C@@H]([C@@H]1O[C@H](C[C@@H](O)CC)CC1)C
Compound: Ochraceopone D
SMILES: O=C1OC(=C(C)C2=C1C=C3[C@H]([C@]4(O)CC(=O)C(C([C@]4([C@H]([C@]3(O2)C)O)O)=O)(C)C)C)C
Compound: (10R,10′R)-wentibianthrone C
SMILES: O=C1C2=C(OC)C=C(OC)C=C2[C@H]([C@H]3C4=C(C(=O)C5=C3C=C(C)C=C5O)C(OC)=CC(=C4)O)C=6C1=C(O)C=C(C)C6
Compound: 7-O-Demethyl-3,8'-bisiderin
SMILES: O=C1OC2=C(C(=CC(=C2)O)C)C(=C1C3=C4OC(=O)C=C(C4=C(C)C=C3OC)OC)OC
Compound: 40-hydroxy oligomycin B
SMILES: O=C1O[C@H]2[C@@H]([C@@]3(O[C@H]([C@H]2C)CC[C@H](C=CC=CC[C@@H](CO)[C@@H]([C@](C([C@H]([C@@H]([C@H](C([C@H]([C@@H]([C@H](C=C1)C)O)C)=O)C)O)C)=O)(O)C)O)CC)O[C@H]([C@@H](C)CC3=O)C[C@H](O)C)C
Compound: Butyl nonactate
SMILES: O=C(OCCCC)[C@H]([C@H]1O[C@@H](C[C@H](O)CC)CC1)C
Compound: Ochraceopone E
SMILES: O=C1OC(=C(C)C2=C1C[C@@H]3[C@@]4([C@](O)(C(C(=O)CC4)(C)C)C[C@H]([C@]3(O2)C)O)C)C
Compound: (1S,3R)-austrocortirubin
SMILES: O=C1C2=C(C(=O)C3=C1[C@@H](O)C[C@@](C3)(O)C)C(O)=C(OC)C=C2O
Compound: Neomacrophorin IV
SMILES: O=C1C=C(C(=O)[C@H]2[C@@]1(O2)C[C@H]3C(=C)CC[C@@H]4[C@@]3(CC[C@H](C4(C)C)O)C)COC(=O)C[C@@H](O)C
Compound: (1S,2S,3R,7S,8S,10S,13S)-2-hydroxy-8-methoxy-5,5,8-trimethyl-12,14-dioxatetracyclo[8.4.0.01,13.03,7]tetradecan-11-one
SMILES: O=C1O[C@@H]2O[C@@]32[C@@H]1C[C@](OC)([C@H]4CC(C[C@H]4[C@@H]3O)(C)C)C
Compound: 8-acetyl homononactic acid
SMILES: O=C(O)[C@H]([C@H]1O[C@@H](C[C@H](OC(=O)C)CC)CC1)C
Compound: Neomacrophorin V
SMILES: O=C1C=C([C@@H](O)[C@H]2[C@@]1(O2)C[C@H]3C(=C)CC[C@@H]4[C@@]3(CC[C@H](C4(C)C)O)C)CO
Compound: Isoasteltoxin
SMILES: O=C1OC(=C(C)C(=C1)OC)/C=C\C=C/C=C/[C@H]2O[C@H]3O[C@H](CC)[C@@]([C@]3([C@H]2O)C)(O)C
Compound: Serialynic acid
SMILES: O=C(O)[C@H](CCC1=C(O)C=C(C#CC(=C)C)C(=C1)O)C
Compound: Malfilamentoside A
SMILES: O=C1OC(OC2O[C@@H]([C@@H](O)[C@@H]([C@H]2NC(=O)C)O)COC)C(=C1C3=CC=CC=C3)CC4=CC=CC=C4
Compound: 16-O-desmethylasporyergosterol
SMILES: O[C@@H]1C[C@@H]2C=CC3=C4[C@](\C(=C(/C=C/C(C(C)C)C)\C)\[C@@H](C4)O)(C)CC[C@@H]3[C@@]2(C)CC1
Compound: Neomacrophorin VI
SMILES: O=C1C=C(C(=O)[C@H]2[C@@]1(O2)C[C@H]3C(=C)CC[C@@H]4[C@@]3(CC[C@H](C4(C)C)O)C)CO
Compound: Pseudohygrophorone A(12)
SMILES: O=C1C=C[C@H](O)[C@@]([C@@H]1O)(O)CCCCCCCCCCCC
Compound: Arthrinin D
SMILES: O=C(OC)[C@]1([C@@H]2[C@]3(C4=C(O)C=C(C)C(=C4[C@@H]([C@H]2O)O)C=C)[C@H](CC1)C3)C
Compound: MR93B
SMILES: O1C=NC(=C1)/C=C(\[C@@H](O)C)/CO
Compound: 16-O-desmethylasporyergosterol-beta-D-mannoside
SMILES: O1[C@@H](O[C@H]2/C(=C(/C=C/C(C(C)C)C)\C)/[C@]3(CC[C@H]4C(=C3C2)C=C[C@H]5C[C@@H](O)CC[C@]45C)C)[C@@H](O)[C@@H](O)[C@@H]([C@H]1CO)O
Compound: Harzianoic acid A
SMILES: O=C(O)C(=CCC[C@@]1([C@@H](C(=O)O)C[C@H]1C(=O)C)C)C
Compound: Pseudohygrophorone B(12)
SMILES: O=C1C=C[C@H](O)[C@@]([C@H]1O)(O)CCCCCCCCCCCC
Compound: Monorden E
SMILES: ClC1=C(O)C=C(O)C2=C1CC(=O)CCCCC=CC[C@@H](OC2=O)C
Compound: 3'-demethyldihydromaldoxin
SMILES: ClC1=C(O)C(OC2=C(C(O)=CC(=C2)C)C(=O)O)=C(C(=O)OC)C=C1O
Compound: 16-O-desmethylasporyergosteron-beta-D-mannoside
SMILES: O=C1C=C2C=CC3=C4[C@](/C(=C(\C=C\C(C(C)C)C)/C)/[C@@H](C4)O[C@@H]5O[C@@H]([C@@H](O)[C@@H]([C@@H]5O)O)CO)(C)CC[C@@H]3[C@@]2(C)CC1
Compound: Harzianoic acid B
SMILES: O=C(O)C(=CCC[C@@]1([C@@H](C(=O)O)C[C@H]1[C@](O)(C(=O)O)C)C)C
Compound: Mohangic acid A
SMILES: O=C(O)C[C@@H](O)/C=C/C=C/C=C/[C@H]([C@@H](O)[C@@H](C[C@H]([C@H](O)CC(=O)C1=CC=C(N)C=C1)C)C)C
Compound: CJ-16,171
SMILES: O=C1NC=C(C2=CC=CC=C2)C3=C1[C@@]4(C=C([C@H](C)O[C@@H]4O3)C)C
Compound: Stachybotrin G
SMILES: S(=O)(=O)(OC1=C(C(O)=CC2=C1C[N+]=3CCCCNC23)C/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)O
Compound: Bisacremine B
SMILES: O1[C@@](C=CC2=CC=C(C)C=C2)(CC[C@@]1(C=CC3=C[C@H](O)[C@@](O)(C)C[C@@H]3O)C)C
Compound: Asperteramide A
SMILES: O=C(OC)NC1=C(C=C(CC2=CC=C(NC(=O)OC)C=C2)C=C1)CC3=CC=C(NC(=O)OC)C=C3
Compound: Epothilone A 3-alpha-D-arabinofuranoside
SMILES: S1C(=NC(=C1)/C=C(/[C@H]2OC(=O)C[C@H](OC3OC(CO)C(C3O)O)C(C(=O)[C@@H]([C@@H](O)[C@H](CCC[C@@H]4[C@H](C2)O4)C)C)(C)C)\C)C
Compound: Mohangic acid B
SMILES: O=C(O)C[C@@H](O)/C=C/C=C/C=C/[C@H]([C@@H](O)[C@@H](C[C@H]([C@H](O)CC(=O)C1=CC=C(NC)C=C1)C)C)C
Compound: Polycavernoside D
SMILES: O=C1OC(/C=C/C=C/C=C/CCC)C([C@@H]2OC(O)([C@@H](C2)C)C(C[C@H]3O[C@@H](C1)C([C@@H](O[C@@H]4OC[C@@H](OC)[C@@H]([C@H]4OC)O[C@@H]5OC[C@@H](OC)[C@@H]([C@H]5O)O)C3)(C)C)=O)(C)C
Compound: Fijiolide B
SMILES: ClC1=C2C=CC3=C1C4=CC=C[C@]4(O[C@@H]5OC([C@@H](N(C)C)[C@H]([C@H]5O)O)(C)C)[C@@H]3OC6=C(Cl)C=C([C@H](CC(OC[C@@H]2O)=O)N)C=C6O
Compound: Altenuic acid IV
SMILES: O=C(O)C1=C(O)C=C(OC)C=C1/C(/C(=C\C(=O)O)/C)=C/C(=O)O
Compound: Mohangic acid C
SMILES: O=C(O)C[C@@H](O)/C=C/C=C/C=C/[C@H]([C@@H](O)[C@@H](C[C@H]([C@H](O)CC(=O)C1=CC=C(NC(=O)C)C=C1)C)C)C
Compound: Blennolide H
SMILES: O=C1C2=C(O)C(C3=C(O)C4=C(O[C@](C(=O)OC)([C@@H]5OC(=O)C[C@H]5C)CC4=O)C=C3)=CC=C2O[C@](C1)(C(=O)OC)[C@@H]6OC(=O)C[C@H]6C
Compound: Kurahyne B
SMILES: O=C(N[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)N2[C@H](C(=O)CC)CCC2)CCC1)C(C)C)C)C(C)C)C)[C@H](CC)C)C)[C@H](CC)C)/C(=C/CCCC#C)/C
Compound: Fulvuthiacene A
SMILES: S1C(=NC(=C1)/C=C/[C@H](OC)[C@H](/C(/OC)=C/C(=O)OC)C)CCCCCCCC(C)C
Compound: Pestalotheol G
SMILES: O=C1C2=C(OC(C1)(C)C)[C@@H]3O[C@@]34C[C@@H](O[C@H]4[C@H]2O)C(O)(C)C
Compound: Mohangic acid D
SMILES: O=C(O)C[C@@H](O)/C=C/C=C/C=C/[C@H]([C@@H](O)[C@@H](C[C@H]([C@H](O)C[C@@H](O)C1=CC=C(NC(=O)C)C=C1)C)C)C
Compound: Bacaryolane A
SMILES: O=C1[C@@]2(CC[C@@H]3C(C)(C)C[C@H]3[C@](C2)(O)CC1)C
Compound: (+)-applanatumol E
SMILES: O=C1OC[C@]2([C@@]1(CC[C@H]2O)CC(=O)C3=C(O)C=CC(=C3)O)C(OC)OC
Compound: Fulvuthiacene B
SMILES: S1C(=NC(=C1)/C=C/[C@H](OC)[C@H](/C(/OC)=C/C(=O)OC)C)CCCCCC(C)C
Compound: Mohangic acid E
SMILES: O=C(O)C[C@@H](O)/C=C/C=C/C=C/[C@H]([C@@H](O)[C@@H](C[C@H]([C@H](O)CC(=O)C1=CC=C(N[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)C=C1)C)C)C
Compound: N-methyl-4-hydroxy-2-quinolinone
SMILES: O=C1N(C2=C(C=CC=C2)C(=C1)O)C
Compound: Bacaryolane B
SMILES: O[C@]12[C@H]3[C@@H](C(C)(C)C3)[C@@H](O)C[C@](C1)(CCC2)C
Compound: 3beta-Hydroxylanosta-7, 9 (11), 24-trien-21-oic acid
SMILES: O=C(O)[C@@H]([C@@H]1[C@@]2([C@@](C=3C([C@@]4(C(C([C@@H](O)CC4)(C)C)CC3)C)=CC2)(C)CC1)C)CCC=C(C)C
Compound: MGD-703
SMILES: S(=O)(=O)(OC1=C(C=C(C(OS(=O)(=O)O)C(OC(=O)C([N+](C)(C)C)CCCN(C(=N)N)CC=C(C)C)C)C=C1)COS(=O)(=O)O)O
Compound: Oxaspirol D
SMILES: O=C1O[C@@](O)(C)[C@@H](C12[C@@H](C=C[C@H]([C@@H]2O)O)/C=C/C=C/CCC)O
Compound: Okaramine R
SMILES: O=C1N[C@H](C(=O)N2C1=CC=3C4=C(C=CC=C4)NC3C(C=C2)(C)C)CC5(O)C(=O)N(C(C=C)(C)C)C6=C5C=CC=C6
Compound: Bacaryolane C
SMILES: O[C@]12[C@H]3[C@@H](C(C)(C)C3)[C@H](O)C[C@](C1)(CCC2)C
Compound: Sch-213766
SMILES: O=C/1N[C@H](CC(O)(C(=O)OC)C)C(\C1=C(\O)/C2[C@H](/C(=C/C)/C)C=C[C@H]3[C@H]2[C@H](C[C@H](C3)C)C)=O
Compound: MGA-771
SMILES: S(=O)(=O)(OC1=C(C=C(C(OS(=O)(=O)O)C(NC(=O)C([N+](C)(C)C)CCCN(C(=N)N)C/C=C(\CCC=C(C)C)/C)C)C=C1)COS(=O)(=O)O)O
Compound: Sorazolon E
SMILES: OC1=C(C(=C2NC3=C(C2=C1)C=CC=C3)C)C
Compound: Pyripyropene G
SMILES: O=C1OC(C2=CN=CC=C2)=CC3=C1[C@H](O)[C@@H]4[C@@]5([C@H](C([C@@H](OC(=O)C)CC5)(C)C)CC[C@]4(O3)C)C
Compound: Luminacin B1
SMILES: O=C(C1=C(O)C=C(O)C(=C1)C(=O)C(C)C)C([C@@H]2O[C@@H](O)[C@]3(O[C@H]3CC)[C@@H](C2)O)C(CC)C
Compound: MGA-787
SMILES: S(=O)(=O)(OC1=C(C=C(C(OS(=O)(=O)O)C(NC(=O)C([N+](C)(C)C)CCCN(C(=N)N)C/C=C(\CCC(O)C(=C)C)/C)C)C=C1)COS(=O)(=O)O)O
Compound: Eudistamide A
SMILES: O=C1O[C@H]([C@H](NC(=O)/C=C/C2=C(C=CC=C2)C)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(N[C@@H](C(NCC(N3[C@H](C(N[C@@H](C(N[C@@H]1CC(C)C)=O)CCCN=C(N)N)=O)CCC3)=O)=O)CCC(=O)N)=O)C(C)C)CC(C)C)CC4=CC=CC=C4)C
Compound: Sorazolon A
SMILES: O=C1[C@@](O)([C@](O)(C=2NC3=C(C2C1)C=CC=C3)C)C
Compound: Pochonin C
SMILES: ClC1=C(O)C=C(O)C2=C1CC(=O)C=CC=CC([C@H](C[C@@H](OC2=O)C)O)Cl
Compound: 1-deoxyaustrocortirubin
SMILES: O=C1C2=C(O)C(OC)=CC(=C2C(=O)C3=C1C[C@@](O)(C)CC3)O
Compound: Eudistamide B
SMILES: O=C1O[C@@H]([C@@H](NC(=O)/C=C/C2=C(C=CC=C2)C)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](CCCCN)C(N[C@H](C(N[C@H](C(N[C@@H](C(N[C@@H](C(N[C@H]1[C@H](O)C(C)C)=O)[C@@H](O)C)=O)CC3=CC=C(O)C=C3)=O)CO)=O)[C@H](O)C(C)C)=O)CC4=CC=C(O)C=C4)CC(C)C)CC5=CC=CC=C5)C
Compound: Salinipeptin A
SMILES: S1C=CNC(=O)[C@@H](NC([C@@H](NC([C@H](C1)NC(=O)[C@H](NC(=O)/C(/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)/C(/NC(=O)[C@@H]2N(C(=O)/C(/NC(=O)[C@H](NC(=O)[C@@H]3N(C(=O)/C(/NC(=O)[C@@H](N(C)C)C)=C/C)CCC3)C)=C/C)CCC2)=C/C)C)C)CCC(=O)N)CC4=CC=CC=C4)C(C)C)[C@@H](CC)C)CCC(=O)N)CO)=C/C)[C@@H](CC)C)=O)CC(C)C)=O)C(C)C
Compound: Sorazolon A2
SMILES: O=C1[C@@](O)([C@](O)(C=2NC3=C(C2[C@H]1[C@H]4C(=O)[C@@](O)([C@@](O)(C)C5=C4C6=C(C=CC=C6)N5)C)C=CC=C3)C)C
Compound: Acaciicolin A
SMILES: O=C1[C@@]2(O)[C@](O)([C@]3(O)CCC([C@@]3(C2)CC1)(C)C)C
Compound: Tryptoquivaline F
SMILES: O=C1N(C=NC2=C1C=CC=C2)[C@H]3C(=O)O[C@@]4(C3)C5=C(C=CC=C5)N6[C@H]4N[C@@H](C)C6=O
Compound: Spithioneine A
SMILES: S(C=1N=C(C[C@H]([N+](C)(C)C)C(=O)O)CN1)[C@@H]2[C@@H](O)[C@]3(C(=O)C=C(N3[C@H]2C)NC(=O)C=C(C)C)C
Compound: Salinipeptin B
SMILES: S1C=CNC(=O)[C@@H](NC([C@@H](NC([C@H](C1)NC(=O)[C@H](NC(=O)/C(/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)/C(/NC(=O)[C@@H]2N(C(=O)/C(/NC(=O)[C@H](NC(=O)[C@@H]3N(C(=O)/C(/NC(=O)[C@@H]([N+]([O-])(C)C)C)=C/C)CCC3)C)=C/C)CCC2)=C/C)C)C)CCC(=O)N)CC4=CC=CC=C4)C(C)C)[C@@H](CC)C)CCC(=O)N)CO)=C/C)[C@@H](CC)C)=O)CC(C)C)=O)C(C)C
Compound: Sorazolon A3
SMILES: O=C1[C@@](O)([C@](OC)(C=2NC3=C(C2C1)C=CC=C3)C)C
Compound: Ganoderique acid X
SMILES: O=C(O)/C(=C/CC[C@H]([C@@H]1[C@@]2([C@@](C=3C([C@@]4(C(C([C@H](O)CC4)(C)C)CC3)C)=CC2)(C)[C@H](C1)OC(=O)C)C)C)/C
Compound: Brasilamide J
SMILES: O=C1O/C(=C\[C@@H](C(=O)N)C)/C=C1C2CCC(O)(COC(=O)C)CC2
Compound: Salinipeptin C
SMILES: S1C=CNC(=O)[C@@H](NC([C@@H](NC([C@H](C1)NC(=O)[C@H](NC(=O)/C(/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)/C(/NC(=O)[C@@H]2N(C(=O)/C(/NC(=O)[C@H](NC(=O)[C@@H]3N(C(=O)/C(/N4C(=O)[C@H](C)N(C4)C)=C/C)CCC3)C)=C/C)CCC2)=C/C)C)C)CCC(=O)N)CC5=CC=CC=C5)C(C)C)[C@@H](CC)C)CCC(=O)N)CO)=C/C)[C@@H](CC)C)=O)CC(C)C)=O)C(C)C
Compound: Spithioneine B
SMILES: S(=O)(C=1N=C(C[C@H]([N+](C)(C)C)C(=O)O)CN1)[C@@H]2[C@@H](O)[C@]3(C(=O)C=C(N3[C@H]2C)NC(=O)C=C(C)C)C
Compound: Sorazolon B
SMILES: O[C@]1(C(C=2NC=3C=CC=CC3C2C[C@H]1O)=C)C
Compound: Welwitindolinone C isothiocyanate
SMILES: ClC1=C[C@H]2C(=O)[C@]([C@@]1(C=C)C)(N=C=S)C3=C4C(=CC=C3)NC([C@@H]4C2(C)C)=O
Compound: Malbranpyrrole F
SMILES: ClC1=C(NC=C1)/C=C/C=C(/C=2OC(=O)C=3C(C)(C)[C@@H](OC3C2)C)\C
Compound: Actinobenzoquinoline
SMILES: O=C1N[C@@]2(C3=C(N=C(C)C=C3)C=4C=CC(=CC4[C@@H]2O)C(=O)C)O[C@H]1C
Compound: Salinipeptin D
SMILES: S1C=CNC(=O)[C@@H](NC([C@@H](NC([C@H](C1)NC(=O)[C@H](NC(=O)/C(/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)[C@@H](NC(=O)[C@@H]2N(C(=O)/C(/NC(=O)[C@H](NC(=O)[C@@H]3N(C(=O)/C(/NC(=O)[C@@H](N(C)C)C)=C/C)CCC3)C)=C/C)CCC2)[C@H](O)C)C)C)CCC(=O)N)CC4=CC=CC=C4)C(C)C)[C@@H](CC)C)CCC(=O)N)CO)=C/C)[C@@H](CC)C)=O)CC(C)C)=O)C(C)C
Compound: Sorazolon C
SMILES: O=CC1=C(C=CC2=C1NC=3C=CC=CC23)C
Compound: Auxarthrol C
SMILES: O=C1C2=C(O)C=C(OC)C=C2C(=O)[C@]34[C@]1(O3)[C@H](O)[C@@H](O)[C@]([C@@H]4O)(O)C
Compound: Actinophenanthroline A
SMILES: O=C(NC1=C(O)C2=NC(=CC=C2C=3C1=CC=C(N3)C)C)[C@@H](O)C
Compound: Taylorflavin A
SMILES: O=C1N=C2C(=O)N(C(=O)NC2=NN1C)C
Compound: Cyrmenin B2
SMILES: O=C(OC)/C(/NC(=O)C(NC(=O)/C(=C/C=C\CCCCC(C)C)/C)=C)=C/OC
Compound: Sorazolon D
SMILES: O=C1C(=O)[C@@](O)([C@@](O)(C)C2=C1C3=C(C=CC=C3)N2)C
Compound: Tumonic acid B
SMILES: O=C(O[C@@H](C(=O)O[C@H](C(=O)O)C)[C@H](CC)C)[C@H]1N(C(=O)[C@@H](C(O)/C(=C/CCCCCCC)/C)C)CCC1
Compound: Actinophenanthroline B
SMILES: O=C1N2C=3C(O)=C(NC(=O)[C@@H](O)C)C4=CC=C(N=C4C3C=C[C@@]2(C)CC1)C
Compound: Hiroshidine
SMILES: O=C1C2=C(C(O)=CC=C2[C@@H]3N([C@@H]([C@@H](O)C)CC3)C)[C@H](O)C45C1(O4)[C@@H](O)[C@@H](CC(=O)OC)O[C@@H]5C
Compound: Cycloarthropsone
SMILES: O=C1C2=C(C=CC(=C2O[C@@]1(O)C)O)/C=C/C
Compound: Sorazolon D2
SMILES: O=C1C(=O)[C@@](O)([C@@](OC)(C)C2=C1C3=C(C=CC=C3)N2)C
Compound: Agrocybone
SMILES: O=C1C2=C3[C@@](O[C@@H]4[C@H]3[C@]5(C(=O)[C@@]6(C(C[C@](C6)(CO)C)=C(C57CC7)C)O4)CC2)(C)[C@H]8C1=CC(C)(C)C8
Compound: Actinophenanthroline C
SMILES: O=C1N2C=3C(O)=C(NC(=O)[C@@H](O)C)C4=CC=C(N=C4C3C=C[C@@]2(C)C=C1)C
Compound: Quaesitic acid
SMILES: O=C1OC2=C(C3=C(C(=O)O[C@@H]3O)C(=C2COC(=O)/C=C/C(=O)O)O)OC4=C1C(=CC(=C4C=O)O)C
Compound: Ralfuranone M
SMILES: O=C1OCC(=C1C(=O)C2=CC=CC=C2)C3=CC=CC=C3
Compound: Sorazolon E2
SMILES: OC1=C(C2=C(O)C(=C(C)C3=C2C4=C(C=CC=C4)N3)C)C5=C(NC6=C5C=CC=C6)C(=C1C)C
Compound: Azotobacter vinlandii ferritin
SMILES: S(CCC(N)C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C=O)CC=1NC=NC1)CCC(=O)N)C(CC)C)C(C)C)C(CC)C)CCCCN)CC(=O)O)CCCCN)C
Compound: Colubricidin A
SMILES: ClC=1N(C(C(=O)N[C@H]2[C@H](OC(=O)C3=C(N)C(=[N+]([O-])C=C3)C(=O)O)C[C@H](OC(C(C(O)C(C(O)C(C4OC(=O)C=CCC(O)CC(O)CC(O)CCC(C(O[C@@H]5[C@@H](O)[C@@H](O[C@@H]([C@H]5O)C)O[C@H]6[C@@H](O[C@H](C)[C@H]([C@@H]6O[C@@H]7O[C@@H]([C@@H](N)[C@@H](C7)O)C)O[C@@H]8O[C@@H]([C@@H](O)[C@@H]([C@H]8O)O[C@@H]9O[C@@H]([C@@H](O)[C@@H](C9)O)C)C)O)C[C@]%10(O)[C@H](O)[C@H](C[C@@H](C(C(CC(C(C(CCCC(C%11C(C4C)O%11)O)O)C)O)O)C)O%10)O)C)C)C)C)C)O[C@@H]2C)=C(C1Cl)Cl)C
Compound: (+)-pestaloxazine A
SMILES: O=C1N[C@]2(ON(C(=O)/C=C(/CCO)\C)CCC2)C(=O)N[C@]13ON(C(=O)/C=C(/CCO)\C)CCC3
Compound: DKxanthene-534
SMILES: O=C(NC(C(=O)O)C(O)C(=O)N)/C(=C/C=C/C=C/C=C/C=C/C(=C/C1N=C(/C=C/C=2NC=CC2)OC1C)/C)/C
Compound: Peniciherquamide A
SMILES: O=C1N[C@]23[C@H](C(C)(C)[C@@]4(C2)C(=O)NC5=C4C=CC6=C5C(=O)CC(O6)(C)C)C[C@]17N(CC[C@@H]7C)C3
Compound: Ralstonin C
SMILES: O=C1NCC(=O)N[C@@H](C(=O)NCCC(=O)OCC[C@H](C(N[C@H](C(NC1=C)=O)C(C)C)=O)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](O)[C@@H](N)CCCCCCCCC/C=C\CCCCCC)[C@H](O)C)[C@@H](O)C2=CC=C(O)C=C2)CO)CCO)C
Compound: Rubetaulfoen
SMILES: O=C1OC[C@H]2[C@]13[C@]([C@@H]4[C@@H](C[C@](C4)(CO)C)[C@@H]2O)(C)C3