MonarchInit/C3PO huggingface dataset:
Compound: Decarestrictine J
SMILES: O=C1O[C@@H](C[C@H](O)CCCC(C1)=O)C
Compound: PAX5
SMILES: O=C1N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(NCCCC[C@H]1NC(=O)[C@@H](NC(=O)CNC(=O)C[C@H](O)CCC/C=C\CCCCCC)CCCCN)=O)CCCCN)CCCCN)CCCCN)CCCCN
Compound: (rel)-4beta,8-dihydroxy-3alpha-O-[alpha-glucopyranosyl]hydroxymethyl-4alpha-methyl-1,2,3,4-tetrahydronaphthalene-1-one
SMILES: O=C1C2=C(O)C=CC=C2[C@](O)(C)[C@@H](C1)CO[C@H]3O[C@H]([C@@H](O)[C@@H]([C@H]3O)O)CO
Compound: Anicequol
SMILES: O=C1[C@H](O)[C@@H]2[C@H]([C@@H](O)C[C@]3([C@H]2C[C@H](OC(=O)C)[C@@H]3[C@@H](/C=C/[C@@H](C(C)C)C)C)C)[C@@]4([C@@H]1C[C@@H](O)CC4)C
Compound: 4-Oxohex-1,6-diyl diacetate
SMILES: O=C(CCOC(=O)C)CCCOC(=O)C
Compound: Clitocybulol E
SMILES: O1[C@@]2(O)[C@](O)(C3=C(C[C@](C3)(CO)C)[C@H]([C@@H]2O)C)C(C1)=C
Compound: (3S)-4,6-dihydro-8-methoxy-3,5-dimethyl-6-oxo-3H-2-benzopyran
SMILES: O=C1C(=C2C(=CO[C@H](C2)C)C(=C1)OC)C
Compound: 6-[(4-hydroxy-3,6-dimethoxy-2-methyl-9H-carbazol-1-yl)methyl]-3-methoxy-1,2-dimethyl-9H-carbazol-4-ol
SMILES: O(C1=C(O)C2=C(NC3=C2C=C(OC)C=C3)C(=C1C)CC4=CC=5C6=C(O)C(OC)=C(C)C(=C6NC5C=C4)C)C
Compound: Falconensin F
SMILES: O=C1C=C2C=C(OC[C@H]2[C@@H]([C@]1(OC(=O)C3=C(OC)C=C(OC)C=C3C)C)O)/C=C/C
Compound: Cordyol D
SMILES: O(C1=C(OC)C(OC)=CC(=C1)C)C2=C(OC)C(OC)=CC(=C2)C
Compound: Roselipin 3D
SMILES: O=C(O[C@@H]([C@H](O)[C@H](O)CO)CO)C(=CC(C(O)C(=CC(C(O)C(=CC(C(O[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@@H]1O)O)CO)C(=CC(CC(CC)C)C)C)C)C)C)C)C)C
Compound: JBIR-111
SMILES: O=C(NC(C(=O)O)(CO)C)/C=C/C(=C/[C@H](C(=O)C1=CC=C(N(C)C)C=C1)C)/C
Compound: Marinactinone B
SMILES: O=C1C(=C(OC(=C1C)OC)CCCCC(C)C)CC
Compound: Aspergilline D
SMILES: O=C1N(C=2C=CC=C3C2[C@@]14O[C@]5(O)[C@](O)(C(=O)N6[C@@]5([C@@H]4[C@H](C6(C)C)C3)O)[C@@H](O)C)C
Compound: Ficiolide K
SMILES: O=C(OC1C(O)C2OC(C1O)CO2)C=CCCC[C@H](O)C
Compound: N-Formylnorloline
SMILES: O=CN[C@@H]1[C@@H]2N3CC[C@@H]2O[C@@H]1C3
Compound: Inonotusane B
SMILES: OC([C@@H]1[C@@H](O)[C@@H]([C@@H]2[C@@]3([C@@](C4=C([C@@]5([C@H](C([C@@H](O)CC5)(C)C)CC4)C)CC3)(C)CC2)C)CC1)(C)C
Compound: 6,7-Epoxy-4(15)-hirsutene-1,5-diol
SMILES: O1[C@@]23[C@@](C(=C)[C@H]([C@@H]12)O)([C@@H]4[C@@H](O)C(C)(C)C[C@@H]4C3)C
Compound: Cladobotric acid B
SMILES: O=C(O)/C=C/C=C/C=C/[C@@H]1[C@@](O)(C(=C[C@H]2[C@H]1CC=C(C2)CO)C)[C@]3(O[C@@H]3[C@@H](CC)C)C
Compound: Simplicilliumtide B
SMILES: O=C(O)C1=C(NC(=O)[C@@H](NC(=O)[C@H](N(C(=O)[C@@H](N)[C@@H](CC)C)C)CC2=CC=CC=C2)C(C)C)C=CC=C1
Compound: 15-hydroxy-16-alpha-D-mannopyranosyloxyisopimar-7-en-19-oic acid
SMILES: O=C(O)[C@@]1([C@H]2[C@@]([C@@H]3C(C[C@](C(O)CO[C@H]4O[C@@H]([C@@H](O)[C@@H]([C@@H]4O)O)CO)(C)CC3)=CC2)(CCC1)C)C
Compound: 1-[(3E)-3-(chloromethylidene)-6-hydroxy-1-benzoxepin-7-yl]ethanone
SMILES: Cl/C=C/1\C=CC=2C(O)=C(C(=O)C)C=CC2OC1
Compound: Symplostatin 1
SMILES: S1C(=NC=C1)[C@@H](NC(=O)[C@@H]([C@@H](OC)[C@H]2N(C(=O)C[C@@H](OC)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C)C)C(CC)C)C(C)C)C)[C@H](CC)C)CCC2)C)CC3=CC=CC=C3
Compound: (-)-chizhine D
SMILES: O=C(O)[C@H](CC(=O)C1=C(O)C=CC(=C1)O)CCC=C(C)C
Compound: Pinophilin B
SMILES: O=C1C=C2C=C(OC[C@H]2[C@@H]([C@@]1(O)C)OC(=O)C3=C(O)C=C(O)C=C3C)/C=C/CO
Compound: Nebularic acid B
SMILES: O=C1[C@@]2(O[C@@H]2[C@]3(CCCC([C@@H]3C1)(C)C)C)C(=O)O
Compound: Sequoiatone F
SMILES: O=C(OC)C=1/C(=C\C(=O)[C@H](CCCCCC)C)/[C@](O)(C)C2C1C=C(OC2)C
Compound: ICM0301 F
SMILES: O=C(/C(=C/C=C/[C@@H]1[C@H](/C(=C/C)/C)[C@]2(O[C@H]2[C@H]3[C@H]1CC[C@@](C3)(O)C)C)/C)C
Compound: Cladospolide E
SMILES: O=C1OC(C(=O)OCCCC1O)C
Compound: 3-(2-(4-Hydroxyphenyl)-2-oxoethyl)-5,6-dihydropyridin-2(1H)-one
SMILES: O=C1NCCC=C1CC(=O)C2=CC=C(O)C=C2
Compound: Dermatolactone
SMILES: O=C1O[C@H]2OCC([C@H]2C1)C3=C(C=C)CC(C3)(C)C
Compound: Pseudonocardone C
SMILES: O=C1C=2C3=C(O)C(O[C@@H]4O[C@H](C(=O)O)[C@@H](O)[C@@H]([C@H]4O)O)=C(C)C=C3C=CC2C(=O)C5=C1C=CC=C5OC
Compound: Naphthomycin M
SMILES: S(C1=C2NC(=O)C(=CC=CC=C[C@@H]([C@@H](O)CC(=O)C(C)=CC[C@@H](C=C[C@@H]([C@@H]([C@H](C=C(C(C=3C(C1=O)=C(C2=O)C=C(C)C3O)=O)C)C)O)C)O)C)C)CC(=O)O
Compound: Argyrin G
SMILES: S1C2=NC(=C1)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C(NC(C(N(CC(N[C@@H]2CO)=O)C)=O)=C)=O)CC)CC=3C4=C(OC)C=CC=C4NC3)CC=5C6=C(C=CC=C6)NC5
Compound: 14,15-irpexanoxide
SMILES: O1[C@@H](OC(C(O)(CC/C=C(/CCC=C(C)C)\C)C)CCC2OC2(CC/C=C(/CCC=C(C)C)\C)C)[C@@H](O)[C@@H](O)[C@@H]([C@H]1CO)O
Compound: Guanacastepene
SMILES: O=C1C2=CC3=C(C=O)[C@@H](O)CC[C@@]3(C)CC[C@]2(C)[C@H]([C@H]1OC(=O)C)C(C)C
Compound: Aeruginopeptin 228-A
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)C(O)CC2=CC=C(O)C=C2)CCC(=O)N)C(=O)N[C@H](C(=O)NC3CCC(N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC4=CC=CC=C4)C)=O)[C@H](O)C)C3=O)O)CC5=CC=C(O)C=C5)C
Compound: Brasiliquinone D
SMILES: O=C1C2=C(C(=O)C=3C1=C(O[C@@H]4O[C@H]([C@H](O)[C@@H](C4)NC(=O)C)C)C=CC3)C=5C(=O)C[C@@H](CC)CC5C=C2O
Compound: SMTP-11L
SMILES: O=C1N([C@H](C(=O)O)C(C)C)CC2=C1C=C(O)C3=C2O[C@]([C@@H](O)C3)(CCC=C(CCC=C(C)C)C)C
Compound: Cinnamomin
SMILES: SCC(NC(=O)C(NC(=O)C(N)C(O)C)C)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)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)NC(C(=O)NC(C(=O)NC(C=O)CO)CO)CCC(=O)O)CO)CC(C)C)C(CC)C)CO)C(C)C)CC(C)C)C(O)C)CCCCN)CC1=CC=C(O)C=C1)C)C)C(O)C)CCC(=O)N)CCC(=O)N)C(O)C)C)C(O)C
Compound: Chaiyaphumine D
SMILES: O=C1O[C@@H]([C@H](NC(=O)C)C(=O)N[C@@H](C(=O)N[C@@H](C(N2[C@H](C(N[C@H]1CC=3C4=C(C=CC=C4)NC3)=O)CCC2)=O)C)CC5=CC=CC=C5)C
Compound: Rubetaujaponol F
SMILES: OC[C@@]1(CC=2C(=C(CCO)C(=CC2C1)C)C)C
Compound: Shorghumoic acid
SMILES: O=C(O)CCCCC[C@H](O)C=CCC=CCCCCCC
Compound: Kasarin
SMILES: O=C1N(OC)C(=C(OC(=O)CC(=O)N)N=C1C(C)C)[C@H](CC)C
Compound: Micromonospolide B
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=C/C=C/C)[C@@H](C)[C@@H](C2)O)O)C)C
Compound: Pitipeptolide D
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)O[C@H](C(=O)N2[C@@H](CCC2)C(N[C@H](C(NCC(O[C@H](C1(C)C)CCCC#C)=O)=O)[C@H](CC)C)=O)[C@H](CC)C)CC3=CC=CC=C3)C(C)C
Compound: Amidenin
SMILES: O=C(N)/C=C/C=C\CCCCC
Compound: (-)-2-epi-botryodiplodinenone
SMILES: O=C(C(=C)[C@H](CO[C@@H]1OC[C@H]([C@H]1C)C(=O)C)C)C
Compound: Neoantimycin F
SMILES: O=C1O[C@H](C(=O)O[C@H]([C@H](NC(=O)C2=C(O)C(NC=O)=CC=C2)C(=O)O[C@H](C(O[C@@H]([C@@H](C1(C)C)O)CC3=CC=CC=C3)=O)C(C)C)C)C(C)C
Compound: (+)-5(6)-dihydro-6-methoxyterrecyclic acid A
SMILES: O=C1[C@@H]([C@@]23[C@@H](C(=O)O)CC[C@@H]([C@@H]2C1)C(C3)(C)C)COC
Compound: Adametacorenol B
SMILES: O=C(O[C@H]1[C@H](C(=C)C)[C@]2(CC=C(CO)[C@H](C2)O)[C@H](C1)C)C
Compound: Indoxamycin D
SMILES: O=C(O)/C=C/[C@@]1(C=C([C@@H]2O[C@@H]([C@]3([C@@]2([C@@H]1C(=C3)C)C)C)/C(=C\C)/CO)C)C
Compound: Xentrivalpeptide P
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)CCC)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)CC)=O)C(C)C)=O)CC3=CC=CC=C3)C
Compound: Campyrone C
SMILES: O=C1OC(=CC(=C1)OC)[C@@H](NC(=O)C)C(C)C
Compound: Colletobredin D
SMILES: ClC1=C(O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)C(=C(O)C3=C1C[C@H](CCCCC)OC3)C
Compound: Oximoaspergillimide
SMILES: O=C(NC(=O)CC(C)C)/C(=N\O)/CC(C)C
Compound: Microsphaeropsisin
SMILES: O=C1C=CC2=C[C@@]3(OC[C@H]([C@@]3(C[C@@]2([C@@H]1C)C)O)C)OC
Compound: Nocazine D/E
SMILES: O=C/1N[C@H](C(=O)N\C1=C/C2=CC=C(OC)C=C2)CC3=CC=CC=C3
Compound: Pteratide II
SMILES: O=C1O[C@@H]([C@H](NC(=O)C2=CC=CC=C2)C(=O)N([C@H](C(=O)N([C@H](C(=O)N3[C@@H](C[C@H](C3)C)C(N([C@H](C(N[C@H](C(N([C@H](C(N([C@H]1C(C)C)C)=O)[C@H](CC)C)C)=O)CC4=CC=CC=C4)=O)C)C)=O)C)C)CC(C)C)C)C
Compound: Spiromastixone E
SMILES: ClC1=C2OC3=C(C=C(O)C=C3CCC)OC(C2=C(CCC)C(=C1O)Cl)=O
Compound: 1,3-Bis(chloromethyl)-2-methyl-5-nitrobenzene
SMILES: ClCC1=C(C(=CC(=C1)[N+](=O)[O-])CCl)C
Compound: (+/-)-eurotiumide F
SMILES: O1C2=C(C=C(O)C3=C2[C@@H](O[C@H]([C@@H]3OC)CCCCC)OC)C=CC1(C)C
Compound: Argyrin D
SMILES: S1C2=NC(=C1)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C(NC(C(N(CC(N[C@@H]2C)=O)C)=O)=C)=O)CC)CC=3C4=C(OC)C=CC=C4NC3C)CC=5C6=C(C=CC=C6)NC5
Compound: Terezine D
SMILES: O=C1N[C@H](C(=O)NC1CC=2C3=C(C(=CC=C3)CC=C(C)C)NC2)C
Compound: Biphenomycin C
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)O)CO)CCCN=C(N)N)[C@H](O)C2=C(O)C=CC(C3=CC(C[C@@H]1N)=C(O)C=C3)=C2)C[C@@H](O)CN
Compound: Aspernigrin C
SMILES: O=C1OC(=CC(=C1)OC)[C@@H](N2C(=CC(=O)C(=C2)C(=O)NC(=O)C[C@@H](C(=O)O)C)CC3=CC=CC=C3)CC4=CC=CC=C4
Compound: 4beta-acetoxyprobotryane-9beta,10beta-diol
SMILES: O=C(O[C@@H]1[C@@H]2[C@@]3(O)[C@](C[C@@H]([C@H]3[C@@H](C1)C)O)(C)CC2(C)C)C
Compound: Pestaloficiol F
SMILES: O=C1C2=C(OC(C1)(C)C)[C@]3(O[C@H]3[C@H](C2)O)CC=C(C)C
Compound: Salinosporamide E
SMILES: O=C1N[C@]2(C(=O)O[C@]2([C@H]1CCC)C)[C@@H](O)[C@@H]3C=CCCC3
Compound: Destruxin-A3
SMILES: O=C1N([C@H](C(=O)NCCC(=O)O[C@H](CC=C)C(N(C(C(N[C@H](C(N([C@H]1C(C)C)C)=O)C(CC)C)=O)C)C)=O)C)C
Compound: Eryloside W
SMILES: O=C(O)[C@]12C3=C([C@@]4([C@H](C([C@@H](O[C@@H]5O[C@H](C(=O)O)[C@@H](O)[C@@H]([C@H]5O[C@@H]6O[C@@H]([C@@H](O)[C@@H]([C@H]6NC(=O)C)O)CO)O)CC4)(C)C)CC3)C)CC[C@@]1([C@@H]([C@@H](CCC(=C)C(C)C)C)CC2)C
Compound: Bengamide F'
SMILES: O=C1N(CCCC[C@@H]1NC(=O)[C@H](OC)[C@H](O)[C@@H](O)[C@H](O)/C=C/C(CC)C)C
Compound: MS-681c
SMILES: O=C(NC(C(=O)N[C@H](C(=O)N[C@](C(=O)NCC(=O)N[C@H](C(=O)N[C@](C(=O)N[C@H](CNCCCNCCCCN)CC1=CC=CC=C1)(CC)C)CC=2NC=3C=CC=CC3C2)(CC)C)C)(C)C)[C@@](NC(=O)[C@@H](NC(=O)C)CC4=CC=CC=C4)(CC)C
Compound: 2-methyl-2,4-hexadiene
SMILES: C(=C/C=C/C)(C)C
Compound: (-)-1-Hydroxybybetaochlamic acid
SMILES: O=C1OC(=O)C2=C1[C@@H](O)[C@@H](CC=3C(=O)OC(C3C[C@H]2CCC)=O)CC
Compound: Ankaflavin
SMILES: O=C1C2=C(C=C(/C=C/C)OC2)CC3C1(OC(=O)C3C(=O)CCCCCCC)C
Compound: 7alpha-Acetoxydeacetylbotryenedial
SMILES: O=C(O[C@H]1[C@@](C2=C(C=O)[C@H](C)C[C@@H]([C@H]2C1(C)C)O)(C=O)C)C
Compound: Ganomastenol B
SMILES: O[C@H]1C(=C)[C@@H]2[C@H](C=C(C)[C@H](C2)O)[C@H]([C@@H]1O)C(C)C
Compound: 8-(4'-O-methyl-alpha-rhamnopyranosyloxy)-2-methyquinoline
SMILES: O1C(OC=2C3=NC(=CC=C3C=CC2)C)C(O)C(O)C(C1C)OC
Compound: Jiangrine C
SMILES: O=CC=1N(C([C@@H](OC)[C@H](O)CO)=CC1)CCC2=CC=C(O)C=C2
Compound: Irlactin D
SMILES: O1[C@@H](O)[C@@H]2C[C@H](O)[C@]3(C(=C2C1)CC(C)(C)C[C@@H]3O)C
Compound: Antiprotealide
SMILES: ClCC[C@H]1C(=O)N[C@@]2([C@]1(OC2=O)C)[C@@H](O)C(C)C
Compound: Communiol B
SMILES: O=C(O)/C=C/C[C@H]1CO[C@@H](C1)[C@@H](O)CC
Compound: Fattiviracin FV-10
SMILES: O=C1OCC2OC(OC(CC(=O)OCC3OC(OC(C1)CCCCCCCCCCCC(OC4OC(C(O)C(C4O)O)CO)CCCCCCCC(O)C)C(O)C(O)C3O)CCCCCCCCCCCCCC(OC5OC(C(O)C(C5O)O)CO)CCCCCCCC(O)C)C(O)C(C2O)O
Compound: (18S )-18-O-a-D-Arabinofuranosyl-(1-6)-b-D-glucopyranosideof protoconstipatic acid
SMILES: O=C1O[C@@H](CCCCCCCCCCCCC[C@H](O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO[C@H]3O[C@H](CO)[C@H]([C@@H]3O)O)C)[C@H](C1=C)C(=O)O
Compound: Tanzawaic acid P
SMILES: Cl[C@@H]1[C@@H](O)[C@@H]([C@H](/C=C/C=C/C(=O)O)[C@@H]2[C@@H]1C[C@@](O)(C)C[C@H]2C)C
Compound: Mutactimycin PR
SMILES: O=C1C2=C(O)C3=C(C[C@](O)(C)C[C@@H]3O[C@@H]4O[C@H]([C@H](O)[C@H]([C@H]4O)OC)C)C(=C2C(=O)C=5C1=C(O[C@@H]6O[C@H]([C@H](O)[C@H]([C@H]6O)O)C)C=CC5)O
Compound: Macrolactin K
SMILES: O=C1OC(CCCC=CCCC(=O)CC(O)CC=CC=CC(CC=CC=C1)O)C
Compound: Dihydroniphimycin
SMILES: O=C1OC(C(CC(CCC/C=C/CCCNC(=NC)N)C)C)CC=CC=CC(O)C(C(O)CC(O)CC(OC(=O)CC(=O)O)CC2OC(CC(C(CCC(C(C(C(C(C(CCC(C1C)O)C)O)C)O)C)O)C)O)(O)C(O)C(C2)O)C
Compound: Hymenopsin B
SMILES: O=C1[C@@]2(O[C@@H]2[C@]3(O)CC4=CC[C@@H]5[C@@]([C@H]4C[C@]63[C@@H]1O6)(CCC[C@]5(CO)C)C)CO
Compound: Aeruginosin DA642B
SMILES: ClC1=C(O)C=CC(=C1)C[C@@H](O)C(=O)N[C@H](C(=O)N2[C@@H]3[C@@H](CC[C@H](C3)O)C[C@H]2C(=O)NCCCCN=C(N)N)CC4=CC=CC=C4
Compound: Cyclomarazine A
SMILES: O=C1N([C@H](C(=O)N[C@H]1CC=2C3=C(C=CC=C3)N(C2)C(C=C)(C)C)C[C@H](CO)C)C
Compound: Cyanopeptolin 880
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@H](OC)CO)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC3=CC=CC=C3)C)=O)[C@H](CC)C)C2=O)O)CCC4=CC=C(O)C=C4)C
Compound: (-)-bipolaride A
SMILES: O=C1OC=2C=3C(C(C)=CC2OC)=C4O[C@H](C(C4=C(C3C1=O)O)(C)C)C
Compound: Genestein G2
SMILES: O=C1C2=C(OC=C1C3=CC=C(O)C=C3)C=C(OC4O[C@H]([C@H](O)[C@H]([C@H]4OC)O)C)C=C2OC5O[C@H]([C@H](O)[C@H]([C@H]5O)O)C
Compound: Ampelomin F
SMILES: O[C@H]1[C@@H](O)C[C@@H](C)[C@@H](C1)O
Compound: Pityriazole
SMILES: O=C(O)C1=C(O)C(=C2NC3=C(C2=C1)C=CC=C3)C=4C5=C(C=CC=C5)NC4
Compound: Anguillosporal
SMILES: O=CC1=C(O)C(=C(O)C=C1[C@H](CCCC)C)CC
Compound: 4-(1-methoxyethyl)-5-methyl-2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzene-1,3-diol
SMILES: O([C@H](C1=C(O)C(=C(O)C=C1C)C/C=C(/CC/C=C(/CCC=C(C)C)\C)\C)C)C
Compound: 2-O-acetylaltersolanol L
SMILES: O=C1C2=C(O)C=C(OC)C=C2[C@H](O)[C@@H]3[C@@H]1C[C@@H](OC(=O)C)[C@]([C@@H]3O)(O)C
Compound: Roseoferin A3
SMILES: O=C(NC(C(=O)NC(CNCCO)C)(C)C)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C1N(C(=O)C(CCCCCCCC)C)CCC1)CC(CC(O)CC(=O)CC)C)C)(C)C)C(CC)C)C(CC)C)(C)C
Compound: Pentacecilide A
SMILES: O=C1O[C@H](CC=2C1=C(O)C=C3O[C@]4(CC[C@@H]5[C@@]([C@H]4CC23)(CCC(C5(C)C)=O)C)C)C
Compound: Aranciamycin I
SMILES: O=C1C2=C(O)C3=C(C[C@](O)(C)C[C@@H]3O[C@@H]4O[C@H]([C@H](O)[C@H]([C@H]4O)O)C)C=C2C(=O)C=5C1=C(O)C=CC5
Compound: Terpendole H
SMILES: O1[C@H](C(O)(C)C)[C@@H](O)[C@@H]2[C@]3([C@@H]1CC[C@]4(C35OC5C[C@@H]6[C@@]4(C=7NC=8C=CC=CC8C7C6)C)C)O2
Compound: Illudosin
SMILES: O=C/C(=C/1\[C@@]([C@@H]2[C@@H](O)CC(C2)(C)C)(C[C@@H]1O)C)/C
Compound: Notoamide E3
SMILES: O=C1N2[C@H](C(=O)N[C@H]1CC=3C4=C(C5=C(OC(C)(C)[C@H]([C@H]5O)O)C=C4)NC3C(C=C)(C)C)CCC2
Compound: (-)-petchioic B
SMILES: O=C(OC)[C@]1(C=C(CCC1)CC)CC(=O)O
Compound: Aselacin C
SMILES: O=C1NCCC(=O)N[C@@H](C(=O)N[C@@H](C(NCC(O[C@@H]([C@@H]1NC(=O)[C@H](NC(=O)CCCCCCCC(=O)/C=C/C=C/CCCCC)CCC(=O)N)C)=O)=O)CO)CC=2C3=C(C=CC=C3)NC2
Compound: Ramariolide B
SMILES: O=C1O[C@@]2(O[C@@H](CCCCCCCCCC)[C@@H]2O)C=C1
Compound: Octahydroheptaprenyl mycolic acyl ester
SMILES: O=C(OC/C=C(\CC/C=C(\CC/C=C(\CCCC(CCCC(CCCC(CCCC(C)C)C)C)C)/C)/C)/C)C(C(O)CCCCCCCCCCCCCCCCCCCC/C=C\CCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCC
Compound: (3R,25R)-3,25-Dihydroxyhexacosyl alpha-D-glucopyranoside
SMILES: O1C(OCC[C@H](O)CCCCCCCCCCCCCCCCCCCCC[C@H](O)C)C(O)C(O)C(C1CO)O
Compound: Saquayamycin G
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](O)[C@@H](C7)O)C
Compound: (7E)-(+)-7-ethyl-10-hydroxy-7-undecene-3,6-dione
SMILES: O=C(/C(=C/C[C@@H](O)C)/CC)CCC(=O)CC
Compound: Chaetomugilide A
SMILES: ClC1=C2C(C3=C(C(=O)C(=CC)C)C(O[C@@]3(C1=O)C)=O)=CN(CCCC(=O)O)C(=C2)C=C[C@H](CC)C
Compound: 5-nitroresorcinol
SMILES: O=[N+]([O-])C1=CC(O)=CC(=C1)O
Compound: (+)-applanatumol F
SMILES: O=C1OC[C@]2([C@@]1(CC[C@@H]2O)CC(=O)C3=C(O)C=CC(=C3)O)C(OC)OC
Compound: Destruxin B2
SMILES: O=C1N([C@H](C(=O)NCCC(=O)O[C@H](CC(C)C)C(N2[C@H](C(N[C@H](C(N([C@H]1C(C)C)C)=O)C(C)C)=O)CCC2)=O)C)C
Compound: Ramalinolic acid
SMILES: O=C(OC1=C(O)C(=C(CCCCC)C=C1O)C(=O)O)C2=C(O)C=C(OC)C=C2CCC
Compound: Phomobutenolide
SMILES: O=C1OCC(=C1)C2=CC(OC)=C(OC)C(=C2)OC
Compound: Poronitin B
SMILES: O=C1C(C(=O)NC(=O)CC(C)C)=CNC(=C1)/C=C/CC/C=C/C=C/C(=O)O
Compound: Dihydroilludin M
SMILES: O[C@@]1(C2(C(=C3[C@@H](O)C(C=C3[C@H]1O)(C)C)C)CC2)C
Compound: 3-[[7-(2-methylpropyl)-1,2,3,5,6-pentathiepan-4-yl]methyl]-1H-indole
SMILES: S1SC(SSC(S1)CC(C)C)CC=2C3=C(C=CC=C3)NC2
Compound: Dasyscyphin D
SMILES: OC1=C(C=CC2=C1[C@@]3([C@@H]([C@@]4([C@H](C([C@@H](O)CC4)(C)C)CC3)C)C2)C)C
Compound: (Z)-5-(hydroxymethyl)-2-(6'-methylhept-2'-en-2'-yl)phenol
SMILES: OC1=C(/C(=C\CCC(C)C)/C)C=CC(=C1)CO
Compound: Aeruginosol A
SMILES: O1[C@H](O)C([C@@H]2[C@@]3([C@@]([C@H]4C([C@@]5([C@H](C([C@@H](O)[C@@H](C5)O)(C)C)CC4)C)=C[C@@H]3O)(C)CC2)C)CC[C@@H]1C(O)(C)C
Compound: Scopulamide
SMILES: O=C(N[C@H](C(=O)O)CO)C1=CC(OC)=C(C(=O)CCC)C(=C1)C
Compound: Hericenone I
SMILES: O=C(OCC1=C(C(O)=C(C/C=C(/CC(=O)C=C(C)C)\C)C(=C1)OC)C=O)CCCCCCC/C=C\CCCCCCCC
Compound: Cycloprodigiosin
SMILES: O(C=1/C(/N=C(C1)C=2NC=CC2)=C/C=3NC(C)=C4C3[C@H](CCC4)C)C
Compound: Inonolane A
SMILES: O=C(O)/C(=C/C(O)C(O)C(O)(C1CCC(CO)CC1)C)/C
Compound: Ustilaginoidin P
SMILES: O=C1C(C=2C(=O)C=C(O)C=3C2C=C4OC(C)=CC(=C4C3O)O)=C5C(=C(O)C6=C(O)C(C)=C(OC6=C5)C)C(=C1)O
Compound: 3-O-2'-phenylethyl-4a,10a-dihydrofusarubin A
SMILES: O=C1C2=C(C(O)=C(OC)C=C2O)C(=O)[C@H]3[C@H]1CO[C@](C3)(OCCC4=CC=CC=C4)C
Compound: Dephostatin
SMILES: O=NN(C1=C(O)C=CC(=C1)O)C
Compound: Mannopeptimycin gamma
SMILES: O=C1N[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(N[C@@H](C(NC1[C@@H](O)[C@H]2NC(N)=NC2)=O)CC3=CC=C(O[C@H]4O[C@@H]([C@@H](O[C@H]5O[C@@H]([C@@H](O)[C@@H]([C@@H]5OC(=O)CC(C)C)O)CO)[C@@H]([C@@H]4O)O)CO)C=C3)=O)[C@H](C6=CC=CC=C6)C)CO)[C@@H](O)[C@H]7N(C(N)=NC7)[C@H]8O[C@@H]([C@@H](O)[C@@H]([C@@H]8O)O)CO
Compound: Metatacarboline F
SMILES: O=C(N[C@H](C(=O)O)C(C)C)C1=NC(=C2NC3=C(C2=C1)C=CC=C3)CCC(=O)N4[C@H](C(=O)O)CCC4
Compound: Hamigeromycin A
SMILES: O=C1O[C@H](CCCC(=O)[C@@H](O)[C@H](CC=CC2=C1C(O)=CC(=C2OC)OC)O)C
Compound: Trans-3-Methylthioacrylic acid
SMILES: S(/C=C/C(=O)O)C
Compound: 5-heptadeca-8′Z,11′Z,16-trienylresorcinol
SMILES: OC1=CC(O)=CC(=C1)CCCCCCC/C=C\C/C=C\CCCC=C
Compound: (1S,5E,7R,9S,11E,13S,16S,17S,18S)-18-benzyl-7,14-dihydroxy-7,9,16-trimethyl-15-methylidene-2,4-dioxa-19-azatricyclo[11.7.0.01,17]icosa-5,11-diene-3,8,20-trione
SMILES: O=C1OC=C[C@@](O)(C(=O)[C@@H](C)CC=C[C@@H]2[C@]3(O1)C(=O)N[C@H]([C@@H]3[C@H](C)C(C2O)=C)CC4=CC=CC=C4)C
Compound: Tylopiol B
SMILES: O=C1[C@]2(C(C3=CCC4[C@@]([C@H](C1)O3)(CC[C@@H](C4)O)C)CC[C@@H]2[C@@H](/C=C/[C@H](C(C)C)C)C)C
Compound: 2,3,4,6,8-pentahydroxy-1-methylxanthone
SMILES: O=C1C2=C(OC3=C1C(=C(O)C(=C3O)O)C)C=C(O)C=C2O
Compound: Azalomycin F3a
SMILES: O=C1OC(C(C=CC=C(C(O)CC(O)CC(O)CC(OC(=O)CC(=O)O)CC2OC(CC(C(CCC(C(C(CC(C(C=CC=C1C)C)O)O)C)O)C)O)(O)C(O)C(C2)O)C)C)C(CCC/C=C/CCCN=C(N)N)C
Compound: Oidioperazine C
SMILES: O=C1N[C@@](OC)(C(=O)NC1=CC=2C3=C(C=CC=C3)NC2)CO
Compound: Xanthoepocin
SMILES: O=C1OC(=CC=2C1=C(O)C3=C(C(=O)C4(OC)C(C3O)(O4)C56OC5(OC)C(=O)C=7C=C8C=C(C)OC(C8=C(C7C6O)O)=O)C2)C
Compound: Heptaprenylcycli-14E,18E-diene
SMILES: C1(=CCC(C(=C)CC/C=C(\CC/C=C(/CC/C=C(/CCCC(CCCC(C)C)C)\C)\C)/C)CC1)C
Compound: Limipterin
SMILES: O=C1NC(=NC=2C1=NC(=CN2)[C@@H](O)[C@@H](OC3OC(C(O)C(C3NC(=O)C)O)CO)C)N
Compound: Niizalactam C
SMILES: O=C1NC[C@@H](C=CC=CC=C(C)[C@@H]2[C@@H](C=C(C=CC(C1)=O)C)[C@H]3[C@H](C(=O)[C@@H](O)[C@H]([C@@H]3O)O)C=C2)C
Compound: Trichoharzianol
SMILES: O=C([C@@]1([C@@H]2[C@@H](C=CC1[C@@H](CC)C)[C@@H]3OCO[C@@H]3C[C@H]2C)C)CCO
Compound: Citreomontanin
SMILES: O=C1OC(=C(C)C(=C1)OC)/C=C/C=C/C=C/C(=C/C(=C/C(=C/C)/C)/C)/C
Compound: Syringolin G
SMILES: O=C1NCCCC[C@H](NC(=O)[C@@H](NC(=O)N[C@H](C(=O)O)[C@H](CC)C)[C@H](CC)C)C(N[C@H](C=C1)C(C)C)=O
Compound: Penicillipyrone A
SMILES: O=C1C2=C(OC(=C1)C)O[C@@H]3[C@@]4([C@H](C([C@@H](O)CC4)(C)C)CC[C@H]3C2)C
Compound: Isofusidienol D
SMILES: O=C1C=2C(C(=O)OC)=COCCC2OC3=C1C(O)=CC(=C3)CO
Compound: Mucorisocoumarin C
SMILES: O=C1OC(=CC=2C1=C(O)C=C(OC)C2)C[C@H](O)C(=O)OC
Compound: Cryptophycin B
SMILES: O=C1N[C@@H](C(=O)NC[C@H](C(=O)O[C@H](C(O[C@@H](CC=C1)[C@@H]([C@H]2O[C@@H]2C3=CC=CC=C3)C)=O)CC(C)C)C)CC4=CC=C(OC)C=C4
Compound: Jadomycin S
SMILES: O=C1C=2N3[C@@H](OC([C@@H]3CO)=O)C=4C=C(C)C=C(C4C2C(=O)C=5C1=C(O[C@@H]6O[C@H]([C@H](O)[C@@H](C6)O)C)C=CC5)O
Compound: Cylindrocyclophane A4
SMILES: ClC(Cl)CCC[C@@H]1C2=C(O)C=C([C@H](O)[C@H](CCCC[C@H](CCCC(Cl)Cl)C3=C(C=C([C@@H]([C@H](CCCC1)C)O)C=C3O)O)C)C=C2O
Compound: Itralamide B
SMILES: ClC(Cl)C(CC(=O)N([C@@H]1C(=O)N([C@H](C(=O)N[C@@H](C(=O)N([C@@H](C)C(N([C@@H](C(N[C@H](C(O[C@@H]1C)=O)C(C)C)=O)CC2=CC=CC=C2)C)=O)C)C(C)C)C)C)C)C
Compound: Clostrubin A
SMILES: O=C1C2=C3C(C(O)=C4C2=CC(C)=CC4=O)=C(O)C=C(C3=C5C1=C(O)C(=C(O)C)C=C5)C
Compound: Chromomycin A2
SMILES: O=C1C2=C(O)C3=C(O)C(=C(O[C@@H]4O[C@@H]([C@H](OC(=O)C)[C@@H](C4)O[C@H]5O[C@@H]([C@H](OC)[C@@H](C5)O)C)C)C=C3C=C2C[C@H]([C@@H]1O[C@@H]6O[C@@H]([C@@H](O)[C@@H](C6)O[C@@H]7O[C@@H]([C@@H](O)[C@@H](C7)O[C@@H]8O[C@H]([C@H](OC(=O)C(C)C)[C@](C8)(O)C)C)C)C)[C@H](OC)C(=O)[C@@H](O)[C@H](O)C)C
Compound: Phomapyrone F
SMILES: O=C1OC2=C(C(=C(C)C=C2C)C)C(=C1C)OC
Compound: Neosartin A
SMILES: O=C1N([C@@](OC)(C(=O)N2C1=CC=3C=CC=CC23)C)C
Compound: Oidiolactone A
SMILES: O=C1O[C@H](OC)[C@@]23O[C@@H]2[C@H]4OC([C@@]5([C@H]4[C@@](C3=C1)(CCC5)C)C)=O
Compound: Dihydrooxosorbiquinol
SMILES: O=C1C(=C(O)C(C)=C([C@]1(O)C)O)C(=O)[C@H]2[C@H]3C(=C(O)[C@]([C@@H]2/C=C/C)(C)C(C3(O)C)=O)C(=O)CC/C=C/C
Compound: Tenellin
SMILES: O=C1N(O)C=C(C2=CC=C(O)C=C2)C(=C1C(=O)/C=C/C(=C/[C@H](CC)C)/C)O
Compound: Citreohybridone B
SMILES: O=C1O[C@H]2C[C@]3(C([C@]14C2C([C@@H](OC(=O)C)CC4)(C)C)C=C([C@]5(C(=O)C(=C([C@@]35C(=O)OC)OC)C)C)C)C
Compound: (24E)-3-oxo-23-hydroxycycloart-24-en-26-oic acid
SMILES: O=C1C([C@H]2[C@@]3([C@]4([C@H]([C@]5([C@]([C@@H]([C@@H](CC(O)/C=C(/C(=O)O)\C)C)CC5)(C)CC4)C)CC2)C3)CC1)(C)C
Compound: 4alpha,5alpha-diacetoxy-9alpha-benzoyloxy-7betaH-eudesman-1beta,2beta,11, 14-tetraol
SMILES: O=C(O[C@H]1[C@@]2([C@](OC(=O)C)([C@](OC(=O)C)(C[C@H]([C@H]2O)O)C)C[C@H](C1)C(O)(C)C)CO)C3=CC=CC=C3
Compound: NBRI17671
SMILES: O=C1C(O)=C([C@](C(=O)CCO)(C)[C@H]2[C@H]1[C@H](O)[C@@H](C[C@@H]2O)C)[C@@H](CCCCCCCCC)C
Compound: NW-G06
SMILES: ClC1=CC=2N[C@H]3N4C(=O)[C@@H]5N(NCCC5)C(=O)[C@@H](N(C(=O)C6N(N=CC(=C6)OC)C([C@@H]7N(C([C@H](NC([C@@H]4C[C@]3(C2C=C1)O)=O)C(C)C)=O)NCCC7)=O)C)C
Compound: 2,3-di-O-(3'R,7'R,11 'R,15 '-tetramethylhexadecyl)-sn-glycerol
SMILES: O(C(COCCC(CCCC(CCCC(CCCC(C)C)C)C)C)CO)CCC(CCCC(CCCC(CCCC(C)C)C)C)C
Compound: 3-Acetyl-4-methoxybenzoic acid
SMILES: O=C(O)C1=CC(=C(OC)C=C1)C(=O)C
Compound: Speramide A
SMILES: O=C1N2[C@@]3(C(=O)N[C@@]14[C@H](C(C)(C)[C@]5(C4)NC=6C=C7C=CC(OC7=CC6C5=O)(C)C)C3)CCC2
Compound: Guignardone K
SMILES: O=C1C2=C(O[C@@]3([C@@H](O)C[C@H]([C@@H]3C2)C(=C)C)C)[C@@H](O)C[C@@]1(O)CO
Compound: 3beta,7beta,15alpha,28-tetrahydroxy-11,23-dioxo-lanost-8,16-dien-26-oic acid
SMILES: O=C1C2=C([C@@]3([C@@H](O)C=C([C@]3(C1)C)[C@@H](CC(=O)CC(C(=O)O)C)C)C)[C@@H](O)C[C@@H]4[C@@]2(CC[C@@H]([C@]4(CO)C)O)C
Compound: methyl 1-(propionic acid)-beta-carboline-3-carboxylate
SMILES: O=C(OC)C1=NC(=C2NC3=C(C2=C1)C=CC=C3)CCC(=O)O
Compound: Glycolipid G2
SMILES: O=C(OC(CO[C@H]1O[C@@H]([C@@H](O)C([C@H]1O)O[C@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)CO)COCCCCCCCCCCCCCCC)CCCCCCCCCCCCCC
Compound: Folipastatin
SMILES: O=C1OC2=C(C(/C(=C\C)/C)=CC(=C2C)O)OC3=C1C(/C(=C\C)/C)=CC(=C3C)O
Compound: Dioxolide A
SMILES: O=C(N)C1=CC=C2O[C@H](O[C@@H]2C1)CO
Compound: Marinone
SMILES: BrC1=C2C(=O)C3=C(O[C@](CCC=C(C)C)(C)[C@H]4[C@@H]3C=C(CC4)C)C(C2=C(O)C=C1O)=O
Compound: Glomecidin
SMILES: O=C1N2NCC(O)C(C2C(=O)N[C@H](C(=O)N[C@@H](C(N[C@@H]1CC=3NC=NC3)=O)[C@@H](CC)C)CC4=CC=C(OC)C=C4)O
Compound: Spiroacaciicolide A
SMILES: O=C1C(O)=C[C@@]2([C@](O)(C(=O)C)CCC2(C)C)CC1
Compound: 6beta-hydroxy-8-dihydroramulosin
SMILES: O=C1O[C@@H](C[C@H]2[C@@H]1[C@@H](O)C[C@H](O)C2)C
Compound: Lydiamycin C
SMILES: O=C1N2N=CCC[C@@H]2C(=O)OC[C@H](NC(=O)C3N(N=CCC3)C(=O)CC(C(=O)O)CCCCC)C(N[C@@H](C(N[C@H]1C)=O)CC(C)C)=O
Compound: Pochonin E
SMILES: ClC1=C(O)C=C(O)C2=C1CC(=O)C=CCC(O)C=CC[C@H](OC2=O)C
Compound: (3R,4S,4aR)-4,8-dihydroxy-3-methyl-3,4,4a,5-tetrahydro-1H-2-benzopyran-1-one
SMILES: O=C1O[C@@H]([C@@H](O)[C@H]2C1=C(O)C=CC2)C
Compound: Rifamycin Y
SMILES: O=C1NC2=C(O)C3=C(O)C(=C4OC(C(C4=C3C(=C2)OCC(=O)O)=O)(OC=CC(OC)C(C(C(C(C(C(C(C=CC=C1C)(O)C)=O)C)O)C)OC(=O)C)C)C)C
Compound: 7-Deoxy-7,14-didehydrosydonic acid
SMILES: O=C(O)C1=CC(O)=C(C(=C)CCCC(C)C)C=C1
Compound: Phomopene
SMILES: O1[C@@H]2[C@](O)(CC[C@H]([C@H]12)C(O)(C)C)C
Compound: Dihydro-3-hydroxy-4-(hydroxymethyl)-3-(1-hydroxy-hexa-2,4-dien-1-yl)-2(3H)-furanone
SMILES: O=C1OCC(C1(O)C(O)/C=C/C=C/C)CO
Compound: Ornatipolide
SMILES: O=C1OCCC2=CC(OC3=CC=C(CC1=O)C=C3)=C(O)C=C2
Compound: Brasilamide I
SMILES: O=C1O/C(=C\[C@@H](C(=O)N)C)/C=C1C2CCC(O)(CO)CC2
Compound: Aqabamycin E1
SMILES: O=[N+]([O-])C1=C(O)C=CC(=C1)C2=C(O)NC(=C2C3=CC=CC=C3)N=O
Compound: Ymf 1029A
SMILES: O1C2=C3C(=C(O)C=C2)[C@@H](O)[C@@H]4[C@H]([C@]35OC6=C7[C@]1(O5)[C@H](O)C[C@@H](C7=CC=C6)O)O4
Compound: 2-butan-2-yl-3-hydroxy-5-(hydroxymethyl)-1H-pyridin-4-one
SMILES: O=C1C(O)=C(NC=C1CO)[C@H](CC)C
Compound: Euparvione
SMILES: O=C1C2=C(OC3=C1COC(=C3)C)C(OC)=C(O)C=C2O
Compound: Trichocitrin
SMILES: O1C2=C3[C@@H](C[C@]4(CC[C@H]([C@@H]4CCC3=C1)C(=C)C)C)[C@@H](C2)C
Compound: ethyl 3-O-acetylganoderate B
SMILES: O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3(C1)C)[C@@H](CC(=O)CC(C(=O)OCC)C)C)C)[C@@H](O)C[C@@H]4[C@@]2(CC[C@@H](C4(C)C)OC(=O)C)C
Compound: Cladospolide C
SMILES: O=C1O[C@@H](CCCCC[C@H]([C@@H](C=C1)O)O)C
Compound: Tenacibactin D
SMILES: O=C(N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN)CC(C)C
Compound: Circulocin gamma
SMILES: O=C1O[C@@H]([C@H](NC(=O)CC(O)CCCCCCCCCCCCCCN=C(N)N)C(=O)N[C@@H](C(=O)N[C@@H]([C@H](CC)C)C(N[C@@H](C(N[C@@H](C(N[C@@H]1C)=O)CC(=O)N)=O)[C@H](O)C)=O)CC(C)C)C
Compound: Cystomanamide C
SMILES: O=C(O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C[C@H](NC[C@]1(OC[C@@H](O)[C@H]([C@@H]1O)O)O)CCCCCC(C)C)CC(=O)N)[C@@H](O)C(=O)N)[C@@H](O)C2=CC=CC=C2
Compound: Phomolactone B
SMILES: O=C1O[C@@H](CC=2C1=C(O)C=CC2O)CCC
Compound: Pyrenulic acid B
SMILES: O=C(O)/C=C/C=C/C=C/[C@@H]1[C@@H](C(=C[C@H]2[C@H]1CC=C(C2)C)C)/C(=C/[C@@H](CC)C)/C
Compound: Cylindrol B1
SMILES: O=C1[C@@H]([C@@](/C=C/C(=C/CC2=C(O)C(=C(C)C=C2O)C=O)/C)([C@H](C)[C@H](C1)OC(=O)C)C)C
Compound: 6-epiophiobolin I
SMILES: O=C1C=C(C)[C@@H]2[C@H]1C(=CC[C@H]3[C@]4(O[C@@H](C=C(C)C)C[C@@H]4C)CC[C@@]3(C2)C)CO
Compound: 6-hydroxymetatacarboline A
SMILES: O=C(O)C1=NC(=C2NC3=C(C2=C1)C=C(O)C=C3)CCC(=O)N4[C@H](C(=O)O)CCC4
Compound: Crocacin C
SMILES: O=C(N)/C=C(/C=C/[C@@H]([C@H](OC)[C@@H]([C@@H](OC)/C=C/C1=CC=CC=C1)C)C)\C
Compound: Trichoverrin B
SMILES: O=C(OC[C@@]12[C@@]3(C4(OC4)[C@H](O[C@@H]1C=C(C)CC2)C[C@H]3OC(=O)/C=C\C=C\[C@H](O)[C@H](O)C)C)/C=C(/CCO)\C
Compound: L-valyl-L-tryptophan anhydride
SMILES: O=C1N[C@H](C(=O)N[C@H]1C(C)C)CC=2C3=C(C=CC=C3)NC2
Compound: Chrysotriazole B
SMILES: O(C1=C(N2N=CN=C2CC3=CC=C(O)C=C3)C=CC(=C1)O)C
Compound: 1-hydroxy-3-sterpurene
SMILES: O[C@@H]1C(CC2C1C(=C3[C@](CC3)(C)C2)C)(C)C
Compound: Almiramide B
SMILES: O=C(N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N)CC1=CC=CC=C1)C)C)C)C(C)C)C(C)C)C)[C@@H](N(C(=O)[C@@H](CCCCC#C)C)C)C(C)C
Compound: Graphiumin G
SMILES: S([C@@]12N(C(=O)[C@]3(SC)CC=4[C@H](N3C1=O)[C@@H](OC(=O)C[C@@H](O)CCCCC)C=CC4)[C@@H]5[C@@H](O)C=COC=C5C2)C
Compound: Applanatumol Z1
SMILES: O=C1C2=C(OC(=C1)CCC(=O)OC)C=CC(=C2)O
Compound: Mer-NF8054A
SMILES: OC12C(=C3C4(C(C(C)C(C4)C(O)C(C(C)C)C)CC3)CC1)C=CC5(C2(CCC(C5)O)C)O
Compound: Erabulenol B
SMILES: O=C1C2=C(O)C(OC)=C(O)C3=C2C(=C4OC(C)C(C4(C3=O)O)(C)C)C(=C1CC5=C(O)C(C(=O)C)=CC(=C5O)C)C
Compound: Lynamicin B
SMILES: ClC1=C(Cl)C=C2C(C=3C(=C(C(=O)OC)NC3)C=4C5=C(C=CC(=C5)Cl)NC4)=CNC2=C1
Compound: Isomigratatin
SMILES: O=C1O[C@H](C(=C[C@@H]([C@H](O)C(OC)=CCCCC=C1)C)C)C(C(=O)CCCC2CC(=O)NC(C2)=O)C
Compound: NW-G09
SMILES: ClC1=C(O)C=C2[C@]3(O)C[C@H]4C(=O)N[C@@H](C(=O)N5NCCC[C@H]5C(=O)N6NCCC[C@@H]6C(N([C@H](C(N7[C@@H](C(N4[C@@H]3NC2=C1)=O)CCCN7)=O)C)C)=O)C(C)C
Compound: BE-54017
SMILES: ClC1=CC2=C(N(C)C3=C2[C@@]4(O)C(=O)N(C)C([C@@]4(O)N5C3=C(OC)C=6C=CC=CC56)=O)C=C1
Compound: Truncateol L
SMILES: O1C2=C(C=C(O)C(=C2)C#CC(=C)C)C[C@@H]1C(O)(C)C
Compound: Loxodin
SMILES: O=C1OC2=C(C(=C(C(=O)OC)C(=C2)O)CCCCC)OC3=C1C(C(=O)CCCC)=CC(=C3)O
Compound: (14RS)-(10E,12E)-14-hydroxy-9-oxo-10,12-octadecadienoic acid
SMILES: O=C(O)CCCCCCCC(=O)/C=C/C=C/[C@@H](O)CCCC
Compound: 13-oxokibdelone A
SMILES: ClC=1C=2C(=O)C3=C(C4=C(O)C=5C(=O)C6=C(C(=O)C[C@@H]([C@@H]6O)O)OC5C(=C4C=C3)OC)C(C2C(=O)N(C1CCC)C)=O
Compound: Catathelasmol E
SMILES: O=C(OC[C@@H](O)CCCOC(=O)C)C
Compound: Cytospolide Q
SMILES: O=C1O[C@H]([C@@H]2O[C@H]([C@H](O)CCCCC)CC2)[C@H]([C@H]1C)O
Compound: Ophiobolin E
SMILES: O=CC1=CCC2=C3C(OC(C=C(C)C)C[C@@H]3C)=C[C@]2(C)C[C@H]4[C@@H]1CC[C@]4(O)C
Compound: Hexadec-8-en-2-one
SMILES: O=C(CCCCC/C=C\CCCCCCC)C
Compound: Manumycin G
SMILES: O=C1C(NC(=O)/C=C/C=C/C=C/C(C)C)=C[C@@](O)(/C=C/C=C/C=C/C(=O)NC2=C(O)CCC2=O)C3C1O3
Compound: Aeruginosin DA688
SMILES: ClC1=C(O)C=CC(=C1)C[C@@H](O)C(=O)N[C@@H](C(=O)N2[C@@H]3[C@@H](CC[C@H](C3)OS(=O)(=O)O)C[C@H]2C(=O)NCCCCN=C(N)N)CC(C)C
Compound: Astraeusin C
SMILES: O=C/C(=C/C=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)CC1)C)C)/C
Compound: Isopyoverdin
SMILES: O=C1N(O)CCCC1NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)[C@H]2NC3=[N+](C=4C(=CC(O)=C(C4)O)C=C3NC(=O)CCC(N)C(=O)O)CC2)CC(=O)O)CCCCN)C(O)C)C(O)C(=O)O)C(O)C)C(O)C
Compound: Ripromycin
SMILES: O=C1NCCCC2NC(=O)C(C2=O)=C(O)C=CC3C(CC=C1)C4C5C(C(C(C(OC)C)C(C5)C)C6C4O6)C3
Compound: Chaetomugilin J
SMILES: ClC1=C2C(=COC(=C2)/C=C/[C@H](CC)C)[C@H](CC(=O)/C(=C/C)/C)[C@@](C1=O)(O)C
Compound: Anhydroaspergillomarasmine B
SMILES: O=C1N(C(C(=O)O)CC(=O)O)CC(C(=O)O)NC1
Compound: Grifolinone B
SMILES: O=C1C(=O)C(=C(C=2OC(C=C(C)C)=CC2CCC/C(=C/CC3=C(O)C=C(C)C=C3O)/C)C(=C1C/C=C(/CC/C=C(/CC(=O)C=C(C)C)\C)\C)O)C
Compound: Eurotiumide G
SMILES: O1C2=C(C=C(O)C3=C2[C@@H](O[C@@H]([C@@H]3OC)CCCCC)OC)C=CC1(C)C
Compound: (S)-N-tetradecanoyl-HSL
SMILES: O=C1OCC[C@@H]1NC(=O)CCCCCCCCCCCCC
Compound: 29-Hydroxybafilomycin D
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)CO)[C@H](C(O)[C@@H](C(=O)/C=C/[C@@H]([C@H](O)C(C)C)C)C)C
Compound: Sirosterol
SMILES: O=C1C=2O[C@]34[C@@](C5C(C6[C@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)CC6)(C)CC5)=C[C@@H]3OC2C=7C(O)=CC(=C8C7C1=C(O)C=9C(C(C)OC89)(C)C)C)(CC[C@@H](C4)O)C
Compound: Salimyxin B
SMILES: O=C1O[C@@]2(O)CC[C@]3([C@H](C2=C1)CC[C@@H]3[C@@H](/C=C/[C@@H](C(O)(C)C)C)C)C
Compound: 3',4'-dihydromonoanhydrobacterioruberin
SMILES: OC(C(/C=C/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/CCC(C(O)(C)C)CC=C(C)C)\C)\C)\C)/C)/C)/C)CCC(O)(C)C)(C)C
Compound: Coniochaetone H
SMILES: O=C1C2=C(OC3=C1[C@](O)(C(=O)OC)CC3)C=C(C)C=C2O
Compound: Paenibacillin A
SMILES: O=C1NC(=CN=C1[C@@H](CC)C)C(C)C
Compound: 4-hydroxy-7-methyl-1-indanone
SMILES: O=C1C2=C(C=CC(=C2CC1)O)C
Compound: Dandamycin
SMILES: O=C1C=C2NC=3C=C(CO)C=CC3O[C@H]2[C@@H]1CO
Compound: Monodechlorovancomycin 2
SMILES: ClC1=C2OC3=C(OC4OC(C(O)C(C4OC5OC(C(O)C(C5)(N)C)C)O)CO)C=6OC7=CC=C([C@@H](O)[C@H]8C(=O)N[C@H](C(=O)O)C=9C(C=%10C=C([C@@H](NC(C(C(=C3)C6)NC(=O)[C@@H](NC([C@@H]([C@@H](C(=C1)C=C2)O)NC(=O)[C@H](NC)CC(C)C)=O)CC(=O)N)=O)C(=O)N8)C=CC%10O)=C(O)C=C(O)C9)C=C7
Compound: Eulatinol
SMILES: O(C1=C(C#CC(=C)C)C=C(O)C=C1)C
Compound: Fluostatin F
SMILES: O=C1C2=C(C=3C(=O)C=4C=CC=C(C4C3C(=C2)O)O)[C@H](OC)[C@@H]5[C@]1(O5)C
Compound: Colletobredin C
SMILES: O1[C@@H](OC2=C3C(=C(C)C(=C2C)O)C[C@H](CCCCC)OC3)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)O
Compound: Petrosifungin B
SMILES: O=C1N2[C@H](C(=O)N3[C@H](C(=O)N4[C@@H](CCCC4)C(O[C@@H]([C@@H](C(N[C@H]1C(C)C)=O)NC(=O)C5=CC=C(O)C=C5)C)=O)CCCC3)CCC2
Compound: Pneumocandin A3
SMILES: O=C1N2[C@H](C(=O)N[C@H](O)CC[C@@H](NC(=O)CCCCCCCC[C@H](C[C@H](CC)C)C)C(=O)N[C@H](C(N3[C@H](C(N[C@H](C(N[C@H]1[C@H](O)CC(=O)N)=O)CCC4=CC=C(O)C=C4)=O)C[C@@H](O)C3)=O)[C@H](O)C)[C@@H](O)[C@H](C2)C
Compound: Pestalotiopyrone E
SMILES: O=C1OC(=CC(=C1)OC)C(C(O)C)C
Compound: 1-hydroxy-3-(2-oxopropyl)-8-methoxycarbonylxanthone
SMILES: O=C1C2=C(OC3=C1C(C(=O)OC)=CC=C3)C=C(CC(=O)C)C=C2O
Compound: TAN-1323D
SMILES: O=C1O[C@@H]([C@@H](OC)C=CC=C(C[C@@H](C)[C@@H]([C@@H]([C@@H]([C@@H](C=C(C=C1OC)C)C)O)CC)O)C)[C@H]([C@@H](O)[C@@H]([C@@]2(O[C@H](/C=C/C)[C@@H](C)[C@@H](C2)OC(=O)/C=C/C(=O)O)O)C)C
Compound: Epothilone I4
SMILES: S1C(=NC(=C1)/C=C(/[C@H]2OC(=O)C[C@H](O)C(C(=O)[C@@H]([C@@H](O)[C@@H](C)CC(CCCC=CC2)C)C)C)\C)C
Compound: Tricycloalternarene 7b
SMILES: O=C1C2=C(OC3(CC=C(C3C2)C(CCC(O)C(O)(C)C)C)C)CCC1OC
Compound: Citrinolactone C
SMILES: O=C1OC2=C([C@@H](OC(=O)C)CC2)C=3C1=C(O)C=C(C)C3
Compound: Curvupallide C
SMILES: O=C1NC(=C)C2=C1[C@H](O)[C@@H](O)[C@@H](O2)/C=C/C=C/C
Compound: Neoatroviridin B
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CO)CC(C)C)CCC(=O)N)(C)C)(C)C)CC(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)CNC(=O)C(NC(=O)C)(C)C)C)CC(C)C)(CC)C)CCC(=O)N)(C)C)CC(C)C)(C)C)(CC)C)(C)C
Compound: Thelephantin H
SMILES: O=C(OC1=C(C(O)=C(OC(=O)CC2=CC=CC=C2)C3=C1OC=4C=C(O)C(=CC34)O)C5=CC=C(O)C=C5)C6=CC=C(O)C=C6
Compound: 2-O-Methylsquamatic acid
SMILES: O=C(OC1=C(C(O)=C(C(=O)O)C(=C1)C)C)C2=C(OC)C(=C(OC)C=C2C)C(=O)O
Compound: Virescenoside R1
SMILES: O1[C@@H](OC[C@@]2([C@@H]3C=CC4=C[C@](C=C)(C)CC[C@@H]4[C@]3(C[C@H]([C@@H]2O)O)C)C)[C@@H](O)[C@H](O)[C@@H]([C@H]1CO[C@H]5O[C@@H]([C@@H](O)[C@@H]([C@H]5O)O)CO)O
Compound: Muraymycin C2
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]3O)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](O)C(C)C)C(=O)O)[C@H]([C@H]2O)O
Compound: Preubetaochromone F
SMILES: O=C1C2=C(O[C@H]3[C@H]1[C@@](O)(C(=O)[C@@H]3C)C(=O)OC)C=CC=C2O
Compound: (ADMAdda5)microcystin-LHar
SMILES: O=C1N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)[C@@H](C(=O)N[C@@H](CCCCN=C(N)N)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(=O)C)CC2=CC=CC=C2)C)/C)=O)C)CC(C)C)C
Compound: Sanguinolentaquinone
SMILES: O=C1C(=O)C=C(NCCCO)C2=C1NC=C2CCO
Compound: Methylstictic acid
SMILES: O=C1OC2=C(C3=C(C(=O)O[C@@H]3OC)C(=C2C)O)OC4=C1C(=CC(=C4C=O)OC)C
Compound: 7-chloromellein-5-ol
SMILES: ClC1=C(O)C=2C(=O)O[C@H](C)CC2C(=C1)O
Compound: Cytochalasin Z8
SMILES: O=C1O[C@@]23C(=O)N[C@H]([C@@H]2C(C)=C([C@H]([C@@H]3C=CC[C@@H]([C@H]([C@H](C=C1)C)O)C)O)C)CC4=CC=CC=C4
Compound: 12-Methyltetradecan-3-one
SMILES: O=C(CCCCCCCC[C@H](CC)C)CC
Compound: 9-O-methylscytalol A
SMILES: O=C1C2=C(OC)C=C(OC)C=C2[C@H](O)[C@H]3[C@H]1CO[C@@](C3)(O)C
Compound: Pyricuol
SMILES: O=CC1=C(O)C=CC=C1/C=C/[C@H](/C=C/C)CO
Compound: Psychrophilin H
SMILES: O=C1N2C3=C(C(O)=CC=C3)C(=C2)[C@@H](O)[C@H](N(C(=O)C)C)C(=O)N4[C@H](C(NC5=C1C=CC=C5)=O)CCC4
Compound: Rhytidchromone C
SMILES: O=C1C2=C(OC(=C1)C)C(=C(OC)C=C2O)[C@@H](OC)C[C@@H](OC)C(=O)OC
Compound: Agaridin
SMILES: S(=O)(=O)(O)N=NC1=CC=C(O)C=C1
Compound: Scalbucillin A
SMILES: O=C(O)C1=C(OC)C=C(O)C(=C1)C(=O)/C=C/C=C/C
Compound: 5-Chloro-6,8-dihydroxy-1-methoxy-3-methyanthraquinone
SMILES: ClC1=C2C(=O)C3=C(C(OC)=CC(=C3)C)C(C2=C(O)C=C1O)=O
Compound: Ganoderlactone B
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@@]4(C(=O)C[C@@H]([C@]4(C1)C)[C@]5(OC(=O)CC5)C)C
Compound: 3-hydroxy-2,5-toluqui­none
SMILES: O=C1C(O)=CC(=O)C=C1C
Compound: (E)-Non-2-en-4,6,8-triynoic acid
SMILES: O=C(O)/C=C/C#CC#CC#C
Compound: Diaporthacol
SMILES: O=C(OCC)/C=C/C(O)\C=C/C=C/C(O)CCC(O)C
Compound: [(3S,4S)-10-hydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromen-4-yl] acetate
SMILES: O=C(O[C@H]1C=2C(=C(O)C3=C(OC)C=C(C=C3C2)OC)CO[C@H]1C)C
Compound: Bromoalterochromide A'
SMILES: BrC1=C(O)C=CC(=C1)/C=C/C=C/C=C/C=C/C(=O)N[C@@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H](C(O[C@@H]2C)=O)CC(C)C)=O)CC(=O)N)CC(=O)N)C(C)C
Compound: 5-aminoimidazole-4-carboxamide
SMILES: NC(=O)c1nc[nH]c1N
Compound: Phomaligol A
SMILES: O=C1C=C(OC)[C@](O)(C)C([C@@]1(OC(=O)C(CC)C)C)=O
Compound: Pestaloficiol Q
SMILES: O=C1C(=C2OC(CC(=C2C[C@@H]1O)OC(=O)C)(C)C)CC=C(C)C
Compound: 3-hydroxy-5-(3-hydroxy-5-methylphenoxy)benzoic acid
SMILES: O=C(O)C1=CC(OC2=CC(O)=CC(=C2)C)=CC(=C1)O
Compound: Sodagnitin D
SMILES: O=C1C([C@H]2[C@]([C@@H]3[C@@]([C@H](C4=CC[C@@H](C(C=5OC(C)(C)C(C5)=O)=C)O[C@H]4O)C(C3)=O)(C)CC2)(C)C[C@H]1OC(=O)CC(O)(CC(=O)O)C)(C)C
Compound: Pyrrocidine B
SMILES: O=C1[C@H]2[C@@H](C=C(C)[C@H]3[C@@H]2[C@H](OC4=CC=C(C[C@]5(C[C@@H]1C(=O)N5)O)C=C4)[C@@H]6[C@H](C[C@H](C[C@@]36C)C)C)C=C
Compound: Fischerindoline
SMILES: O=C(O[C@@H]1[C@]2(O)[C@H](C=C([C@H]1OC(=O)C)C)[C@H](C(=C)C)CC[C@H]2C)[C@H]3N[C@@H]4N(C=5C=CC=CC5[C@@]4(C3)O)C
Compound: Mullinamide B
SMILES: S(CC[C@@H]1NC(=O)[C@@H]2N(CCC2)C([C@@H](NC1=O)CCC(=O)O)=O)C
Compound: Melleolide L
SMILES: ClC1=C(O)C=C(O)C(=C1C)C(=O)O[C@H]2[C@@]3(O)C(=C[C@@H]4CC([C@@H]([C@@H]4[C@@]3(C)C2)O)(C)C)C=O
Compound: Terrestrol A
SMILES: O(CC1=C(O)C=C(CC2=C(O)C=C(CC3=C(O)C=CC(=C3)O)C(=C2)O)C(=C1)O)C
Compound: Ergosta-7,22-diene-3-one
SMILES: O=C1CC2[C@]([C@@H]3C([C@H]4[C@]([C@@H]([C@@H](C=CC(C(C)C)C)C)CC4)(C)CC3)=CC2)(C)CC1
Compound: 19,21-Dibromooscillatoxin A
SMILES: BrC1=C(O)C=C([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)C(=C1)Br
Compound: 1-(3,5-dihydroxyphenyl)-4-hydroxypentan-2-one
SMILES: O=C(CC1=CC(O)=CC(=C1)O)C[C@@H](O)C
Compound: Altersetin
SMILES: O=C1N[C@@H](C(O)C)C(C1=C(O)[C@@]2([C@@H](C=C[C@H]3[C@H]2CC[C@H](C3)C)/C=C/C=C/C)C)=O
Compound: EH21A2
SMILES: O=C1NC2=CC(O)=CC(=C2)C[C@H](C[C@H](OC)[C@H](O)[C@H](C=C([C@@H]([C@H](CCC=C1C)OC)OC(=O)N)C)C)C
Compound: Penicisochroman B
SMILES: O=C1C2=C(C3=C(C[C@H](C)O[C@H]3OC)C=C2)OC1C(C)C
Compound: 5-(3',3'-dimethylallyloxy)-7-methoxy-6-methylphthalide
SMILES: O=C1OCC=2C1=C(OC)C(=C(OCC=C(C)C)C2)C
Compound: Sterostrein L
SMILES: O=C1C2=CC(C)(C)C[C@@H]2[C@](O)(C)C(=C1)CCO
Compound: Aflaquinolone D
SMILES: O=C1NC2=C(C(O)=C(/C=C/C3(CC(C(=O)CC3)C)C)C=C2)[C@@]([C@@H]1OC)(O)C4=CC=CC=C4
Compound: Dityromycin
SMILES: O=C1N2[C@H](C(=O)N[C@@H]3C(=O)N([C@H](C(=O)N(C(C(=O)O[C@@H]([C@H](N(C)C)C(N[C@H](C(N[C@H](C(N4[C@H](C(N([C@H](C(NC1=C(C5OC5)CO)=O)C(C)C)C)=O)CCC4)=O)C6=CC=CC=C6)=O)C(C)C)=O)C)=CC7=CC=C(OC=8C=C(C3O)C=CC8OC)C=C7)C)C(C)C)C)CCC2
Compound: Abscisterol C
SMILES: O=C(C1=CC[C@@H]2[C@@]1(CC[C@H]3C2=CC[C@H]4[C@@H]5[C@@H](O)CC[C@]34CO5)C)CCC(=C)C(C)C
Compound: 4-acetamido-2-amino-6-nitrotoluene
SMILES: CC(=O)Nc1cc(N)c(C)c(c1)[N+]([O-])=O
Compound: Aspinotriol A
SMILES: O[C@H](/C=C(/C=C/[C@H](O)C)\CO)C
Compound: Apoptolidin C
SMILES: O=C1O[C@@H](C[C@H](OC)CCCC=C(C=C[C@H]([C@@H](C=C(C=C(C=C1C)C)C)C)O[C@@H]2O[C@H]([C@H](OC)[C@H]([C@@H]2O)O)C)C)C[C@@]3(O[C@@H]([C@H](C)[C@@H]([C@H]3C)O)C[C@@H](O[C@@H]4O[C@H]([C@H](O[C@@H]5O[C@@H]([C@@H](O)[C@@H](C5)OC)C)[C@](C4)(O)C)C)COC)O
Compound: Prodigiosin R1
SMILES: O(C=1C(N=C(C1)C=2NC=CC2)=CC=3NC=4CCCCCCCC[C@@H](C3C4)CC(C)C)C
Compound: N-[4-amino-1-[[1-[[4-amino-1-oxo-1-[[6,9,18-tris(2-aminoethyl)-3-(1-hydroxyethyl)-15-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-12-propan-2-yl-1,4,7,10,13,16,19-heptazacyclotricos-21-yl]amino]butan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxobutan-2-yl]-6-methylheptanamide
SMILES: O=C1NC(C(=O)NC(C(=O)NC(C(=O)NCCC(C(NC(C(NC(C(NC1C(C)C)=O)CC(C)C)=O)CCN)=O)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CCCCC(C)C)CCN)C(O)C)CCN)C(O)C)CCN)CCN
Compound: Epothilone A1
SMILES: S1C(=NC(=C1)/C=C(/[C@H]2OC(=O)C[C@H](O)C(C(=O)[C@@H]([C@@H](O)[C@H](CCC[C@@H]3[C@H](C2)O3)C)C)C)\C)C
Compound: FR-66979
SMILES: O=C(OC[C@H]1C2=C(O)C=C(CO)C=C2N3C[C@H]4[C@@H]([C@@]1(O3)O)N4)N
Compound: Salinipostin C
SMILES: [P@]1(=O)(OC(=C2C(=O)OC[C@H]2CO1)CCCC)OCCCCCCCCCCCCC
Compound: Tolypyridone A
SMILES: O=C1NC=C(C2=CC=C(O)C=C2)C3=C1[C@H]4[C@@H](C[C@H](C)C[C@@H]4C)[C@H](O3)C
Compound: Myrothecol E
SMILES: O=C1C=C([C@H](O)[C@@H]2[C@]1(O2)C[C@H]3C(=C)CC[C@@H]4[C@@]3(CCC[C@]4(COC(=O)C)C)C)CO
Compound: Pestalotiopamide D
SMILES: O=C(NCCC(=O)OC)/C=C(/CCOC(=O)C)\C
Compound: Arthropsolide D
SMILES: O=C1OC(=C)[C@@H]([C@@]12[C@@H](C=C[C@H]([C@@H]2O)O)/C=C/C)O
Compound: Pyrenochaetolide B
SMILES: O=C1OC(=C(C(O)CC(O)C)C=C1)C
Compound: Fusaranthraquinone
SMILES: O=C1C2=C(O)C=C(OC)C(=C2[C@@H](O)[C@@H]3[C@@H]1C[C@@H](O)[C@](C3)(O)C)O
Compound: Banegasine
SMILES: O=C(O)[C@H]1NC=C(C1)C2=C(N)C=CC=C2
Compound: Ficipyrone B
SMILES: O=C1OC2C(C(=O)O[C@H]2CCCCCC)C(=C1)OC
Compound: BE-52440B
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)CCO)C)=O
Compound: Akanthomycin
SMILES: O=C1N(O)C=CC(=C1[C@H]2[C@@H]([C@@](O)(C[C@@H](C[C@@H]2C)C)C)C)O
Compound: methyl aeruginosate A
SMILES: O=C(O[C@H]1[C@H](OC(=O)C)C(C2CCC3C([C@]2(C1)C)=C[C@H](O)[C@@]4([C@@H]([C@@H]5C(O[C@@H](C(O)(C)C)CC5)O)CC[C@@]34C)C)(C)C)CC(O)(CC(=O)OC)C
Compound: Trichodecenin I
SMILES: O=C(NCC(=O)N[C@H](C(=O)N[C@H](CO)CC(C)C)[C@H](CC)C)C(NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)CC/C=C\CCCCC)CC(C)C)(C)C
Compound: Diphenazithionin
SMILES: S(C1=C(O)C2=NC=3C(=CC=CC3C(=O)O)N=C2C(=C1)C(=O)OC)C4=CC5=NC=6C(=CC=CC6C(=O)O)N=C5C(=C4)C(=O)OC
Compound: Thelephantin A
SMILES: O=C(OC1=C(O)C(=C(OC(=O)CCC)C(=C1C2=CC=C(O)C=C2)O)C3=CC=C(O)C=C3)C4=CC=C(O)C=C4
Compound: Salinamide D
SMILES: O=C1NCC(=O)OC[C@@H]2NC(=O)[C@H](NC(=O)[C@H](CC3=CC=CC=C3)N(C([C@H](C4=CC=C(O[C@@H]([C@@]5(C=C1)OC5)C)C=C4)NC(=O)[C@H](NC([C@H]([C@H](OC2=O)C)NC(=O)[C@@H]([C@H](O)C(C)C)C)=O)C(C)C)=O)C)[C@@H](O)C
Compound: Phomadecalin A
SMILES: O1[C@@]2(C(=C)CO)[C@H](O)C=C3[C@]([C@@H]12)([C@H](CC=C3)C)C
Compound: 35-O-Phenylacetyl bacteriohopanetetrol triacetate
SMILES: O=C(OC[C@H](OC(=O)C)[C@H](OC(=O)C)[C@H](OC(=O)C)CC[C@H]([C@@H]1[C@H]2[C@]([C@@H]3[C@@]([C@]4([C@@H]([C@@]5([C@H](C(CCC5)(C)C)CC4)C)CC3)C)(C)CC2)(C)CC1)C)CC6=CC=CC=C6
Compound: Ficiolide C
SMILES: O=C1O[C@@H](CC(O)CC=CC(=O)O[C@@H](CC[C@H](C=C1)O)C)C
Compound: Octahydromenaquinone MK-9(II,III,VIII,IX)
SMILES: O=C1C2=C(C(=O)C(=C1C/C=C(/CCCC(CCCC(CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CCCC(CCCC(C)C)C)\C)\C)\C)\C)C)C)\C)C)C=CC=C2
Compound: Chaetomugilin G
SMILES: ClC1=C2C(=COC(=C2)/C=C/[C@H]([C@H](O)C)C)C3C(C(=O)OC)=C(O[C@@]3(C1=O)C)[C@@H]([C@H](O)C)C
Compound: Penialidin C
SMILES: O=C1C2=C(OC3=C1COC(=C3)C)C(=C(O)C(=C2)O)C(=O)O
Compound: Trichlornorlichexanthone
SMILES: ClC1=C2OC3=C(C(=C(Cl)C(=C3)O)C)C(C2=C(O)C(=C1O)Cl)=O
Compound: Acremoxanthone B
SMILES: O=C1C2=C(O)C3=C(C[C@@]45[C@@H](OC(=O)C)C=6C=C(C)C=C(C6C([C@]5(C([C@H]3C=C4)=O)O)=O)O)C=C2OC=7C1=C(C(O)=CC7)C(=O)OC
Compound: 4-acetylcytidine
SMILES: CC(=O)C1(N)NC(=O)N(C=C1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Compound: Curvularide B
SMILES: O=C(N[C@@H]([C@H](CC)C)CO)/C=C/[C@]1(OC1[C@H](C[C@H](O)CC)C)C
Compound: BMY-41219
SMILES: O=C1NC(=O)C2=C1C3=C(N([C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO)C5=C3C=CC=C5)C6=C2C7=C(C=CC=C7)N6
Compound: 3-Hydroxyjuglone
SMILES: O=C1C2=C(O)C=CC=C2C(O)=CC1=O
Compound: Tuberin
SMILES: O=CNC=CC1=CC=C(OC)C=C1
Compound: Serratiochelin C
SMILES: O=C(O[C@@H]([C@H](N)C(=O)NCCCNC(=O)C1=C(O)C(O)=CC=C1)C)C2=C(O)C(O)=CC=C2
Compound: (+)-chizhine F
SMILES: O=C1O[C@@H](C2=C(O)C=CC(=C2)O)C=C1CCC=C(CC(=O)C=C(C)C)C
Compound: Microcin J25
SMILES: O=C1N2C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NCC(=O)NCC(=O)NC(C(=O)NCC(=O)NC(C(NC(C(N3C(C(NC(C(NC(C(NC(C(NC(C(NCC(NC(C(NCC(NC1C(O)C)=O)=O)C(CC)C)=O)=O)C(C)C)=O)CC4=CC=CC=C4)=O)CC5=CC=C(O)C=C5)=O)CCC(=O)O)=O)CCC3)=O)C(C)C)=O)CC=6NC=NC6)C)CC7=CC=C(O)C=C7)CC8=CC=CC=C8)CO)C(CC)C)CCC2
Compound: Isohirsut-4-ene
SMILES: C1(=CCC2(C1C3C(CC(C3)(C)C)C2)C)C
Compound: Citreoviripyrone B
SMILES: O=C1OC(=C(C)C(=C1)OC)/C=C/C=C/C=C/C
Compound: Radianspene M
SMILES: O=C1C(=C2C=C3C(=O)C(O)=C([C@@]3(C)CC[C@]2(C)CC1)C(C)C)CCC4=C5C=C6C(=O)C(O)=C([C@@]6(C)CC[C@@]5(CCC4=O)C)C(C)C
Compound: Pyripyropene H
SMILES: O=C1OC(C2=CN=CC=C2)=CC3=C1[C@H](O)[C@@H]4[C@@]5([C@H](C([C@@H](OC(=O)CC)CC5)(C)C)CC[C@]4(O3)C)C
Compound: Syringomycin A1
SMILES: ClCC(O)C1NC(=O)C(NC(=O)/C(/NC(=O)C(NC(=O)C(NC(=O)C(NC(C(NC(C(NC(C(COC1=O)NC(=O)CC(O)CCCCCCC)=O)CO)=O)CCN)=O)CCN)CCCN=C(N)N)CC2=CC=CC=C2)=C/C)C(O)C(=O)O
Compound: Isochromophilone VIII
SMILES: ClC=1C(=O)[C@](O)([C@H](OC(=O)C)[C@H]2C1C=C(OC2)/C=C/C(=C/C(CC)C)/C)C
Compound: Butyl lucidenate N
SMILES: O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3(C1)C)[C@@H](CCC(=O)OCCCC)C)C)[C@@H](O)C[C@@H]4[C@@]2(CC[C@@H](C4(C)C)O)C
Compound: Agariblazeispirol C
SMILES: O=C1C(=C2CC[C@]3([C@]2([C@@H]1[C@@H](C(O)(C)C)C)C=CC=4C(=C(OC)C=CC34)C)C)C
Compound: Epicoccin N
SMILES: S1S[C@H]2[C@H](O)[C@H]3N4[C@]1(C(=O)N5[C@@H]6[C@@H](O)[C@@H](O)CC([C@@H]6C[C@]5(C4=O)SC)=O)C[C@H]3C(C2)=O
Compound: 1,5-dihydroxy-3-(2-oxopropyl)-6-methoxycarbonylxanthone
SMILES: O=C1C2=C(OC3=C1C=CC(=C3O)C(=O)OC)C=C(CC(=O)C)C=C2O
Compound: Pyrenophorin
SMILES: O=C1OC(CCC(=O)C=CC(=O)OC(CCC(C=C1)=O)C)C
Compound: 5-hydroxy-3-methyl-4-(1-hydroxylethyl)-furan-2(5H)-one
SMILES: O=C1OC(O)C(=C1C)C(O)C
Compound: Crocadepsin B
SMILES: ClC1=C(OC)C=CC(=C1)[C@H]2OC(=O)[C@@H](NC(=O)[C@@H](N)[C@H](CCNC([C@@H](NC(C[C@@H]([C@H]2NC(=O)/C(/NC(=O)/C=C/C3=CC=CC=C3)=C\C)O)=O)[C@@H](O)C(=O)N)=O)C)CC(=O)O
Compound: 4-amino-2-hydroxylamino-6-nitrotoluene
SMILES: Cc1c(NO)cc(N)cc1[N+]([O-])=O
Compound: AAL Toxin Tc1
SMILES: O=C(O)[C@@H](CC(=O)O[C@H]([C@H](O)[C@@H](CC)C)C[C@H](CCCCCCCC[C@H](O)CN)C)CC(=O)O
Compound: Ulongamide D
SMILES: S1C2=NC(=C1)C(=O)N[C@@H]([C@@H](C(=O)O[C@@H](C(C)C)C(N([C@H](C(N([C@H](C(N[C@H]2C)=O)C(C)C)C)=O)CC3=CC=C(O)C=C3)C)=O)C)CCC
Compound: Eupenicinicol A
SMILES: O=C(/C=C\O)[C@@]1([C@@H]2[C@@H](C=C[C@@H]1[C@@H](CC)C)[C@H](O)[C@H](O)C[C@H]2C)C
Compound: MK800-62F1
SMILES: O1[C@@H](O[C@H]2[C@]3([C@H](C4=CCC5[C@@]6(C([C@]([C@@H](O)CC6)(CO)C)CC[C@]5([C@]4(C)CC3)C)C)CC([C@H]2O)(C)C)C)[C@H](O)[C@@H](O)[C@H](C1)O
Compound: (1S,3R)-1,3,8-trihydroxy-6-methoxy-3-methyl-1,2,3,4-tetrahydro-9,10-anthraquinone
SMILES: O=C1C2=C(O)C=C(OC)C=C2C(=O)C3=C1[C@@H](O)C[C@@](C3)(O)C
Compound: Phaeofuran B
SMILES: O1[C@@H](C=2[C@@H](O)[C@H]3O[C@H]3[C@@H](C2C1)O)C(O)CCC
Compound: Spiropolin A
SMILES: O=C1O[C@]2(C(C(=O)O)=C[C@](C=C)(C)CC2)[C@@]3([C@@H]1[C@@](CC[C@H]3O)(CO)C)C
Compound: Sorbicillactone B
SMILES: O=C1O[C@@]2(C(O)=C(C)C(=C([C@@H]2[C@@]1(NC(=O)/C=C/C(=O)O)C)C(=O)CC/C=C/C)O)C
Compound: 2-acetyl-1,2,3,4-tetrahydro-beta-carboline
SMILES: O=C(N1CC=2NC=3C=CC=CC3C2CC1)C
Compound: Melithiazol G
SMILES: S1C(=NC(=C1)/C=C/C(OC)C(/C(/OC)=C\C(=O)OC)C)C=2N=C(C(CC)C)SC2
Compound: Notamide F
SMILES: O=C1N2[C@@]3(C(=O)N[C@]14[C@@H](OC)C=5C6=C(C7=C(OC(C)(C)C=C7)C=C6)NC5C([C@@H]4CC3)(C)C)CCC2
Compound: Benthocyanin A
SMILES: O=C1OC2=CC3=NC=4C(C(=O)O)=CC=CC4N(C3=CC2=C1C5=CC=CC=C5)CC=C(CCC=C(C)C)C
Compound: (7beta,15alpha)-7,15-dihydroxysoyasapogenol B
SMILES: O[C@@H]1[C@@]2(C(=CC[C@H]3[C@]2([C@@H](O)C[C@H]4[C@]([C@@H](O)CC[C@]34C)(CO)C)C)[C@@H]5CC(C)(C)C[C@H]([C@@]5(C1)C)O)C
Compound: (22E,24R)-3-acetoxy-19(10-->6)-abeo-ergosta-5,7,9,22-tetraen-3beta-OL
SMILES: O=C(O[C@@H]1CC2=C(C3=C([C@H]4[C@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)CC4)(C)CC3)C=C2C)CC1)C
Compound: Cyclo-(Leu-Ile)
SMILES: O=C1NC(C(=O)NC1C(CC)C)CC(C)C
Compound: Oxopropaline E
SMILES: O=C(C1=NC=C(C)C2=C1NC=3C=CC=CC23)CCO[C@@H]4O[C@H]([C@H](O)[C@H]([C@H]4O)O)C
Compound: Blazeispirol U
SMILES: O=C1C=C2C=CC=3[C@]45O[C@@]6(OC(C)(C)[C@H]([C@H]6O)C)[C@@H](C)[C@H]([C@@]4(C)C=CC3[C@@]2(C)CC1)CC5
Compound: 4-Methoxymethyl-3-[(2-methyl-4-indolyl)-methyl]-2-methylindole
SMILES: O(CC1=C2C(NC(=C2CC3=C4C(NC(=C4)C)=CC=C3)C)=CC=C1)C
Compound: Hygrocin F
SMILES: O=C1O[C@H](C=C[C@H](CCC(=O)C=2C3=C([C@@]4([C@@H](C=C(C1=O)C)C(=O)NC4=CC3=O)O)C=C(C)C2O)CC)[C@H](O)C
Compound: Cymbimicin B
SMILES: O=C1OC(C2=CC=CC=C2)C(C1NC(=O)C(NC(=O)C(C(OC)CC(O)/C(=C/CC3OC(/C=C/C=C/CC(OC)CC(=O)/C=C/C(=C/C=C/C4C(O)C(O)(C(C)OC4)C)/C)C(C)C(C3CC)O)/C)C)C(C)C)C
Compound: (16R)-hydroxyroquefortine C
SMILES: O=C1N2[C@](O)(C(=O)NC1=CC=3NC=NC3)C[C@@]4([C@H]2NC=5C=CC=CC45)C(C=C)(C)C
Compound: Trichorovin-XI
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2C(C(=O)NC(CO)CC(C)C)CCC2)(C)C)CC(C)C)CC(C)C)CCC1)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C)(C)C)CC(=O)N)CC(C)C)CC(C)C)(C)C
Compound: Halichoblelide B
SMILES: O=C1O[C@@H]([C@H](C=CC=CC(=O)O[C@@H]([C@H](C=CC=C1)C)[C@H]([C@@H](O)[C@@H]([C@@]2(O[C@@H]([C@@H](CC)[C@@H](C2)OC)C)OC)C)C)C)[C@H]([C@@H](O)[C@@H]([C@@]3(O[C@@H]([C@@H](CC)[C@@H](C3)O[C@@H]4O[C@H]([C@@H](O)[C@H](C4)O)C)C)OC)C)C
Compound: Spindomycin A
SMILES: O=C1C2=C([C@]3(C(=O)N(C)C4=C3C=CC=C4)[C@@H]([C@H]1O)C)CCC2
Compound: Camphosterol A
SMILES: O=C1O[C@H]2CC[C@]3([C@H](C2=C1)CC[C@@H]3[C@@H](/C=C/[C@@H](C(CO)C)C)C)C
Compound: (3S)-10-[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-7,9-dimethoxy-3-methyl-1H-benzo[g]isochromen-4-one
SMILES: O=C1C=2C(=C(OC3OC(C(OC)C(C3O)O)CO)C4=C(OC)C=C(C=C4C2)OC)CO[C@H]1C
Compound: Versicolactone D
SMILES: O=C1O[C@](C(=O)OC)(CC2=CC(=C(O)C=C2)CC=C(C)C)C(=C1O)C3=CC=C(OC)C=C3
Compound: Oxyphysodic acid
SMILES: O=C1OC2=C(C(=C(C(=O)O)C(=C2C)O)CCCCC)OC3=C1C(=CC(=C3O)O)CC(=O)CCCCC
Compound: Daedaleaside D
SMILES: O=C1C([C@H]2[C@](C3=C([C@]4([C@]([C@@H]([C@H](C(=O)OC5O[C@@H]([C@@H](O)[C@@H]([C@H]5O)O)CO)CCC(=C)C(C)C)[C@@H](C4)OC(=O)C)(C)CC3)C)CC2)(C)CC1)(C)C
Compound: Ganohainanic acid C
SMILES: O=C1C2=C([C@]3(CCC(C([C@@H]3C1)(C)C)=O)C)CC[C@]4([C@]2([C@H](O)C[C@@H]4[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C)C
Compound: 8,9-dihydrogreensporone D
SMILES: ClC1=C(O)C=C(OC)C2=C1CC(=O)CCCC[C@@H](CC[C@@H](OC2=O)C)O
Compound: Polymyxin E4
SMILES: O=C1NCCC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CCCCCC)CCN)C(O)C)CCN)C(=O)NC(C(=O)NC(C(=O)NC(C(NC(C(NC(C(NC1C(O)C)=O)CCN)=O)CCN)=O)CC(C)C)CC(C)C)CCN
Compound: Daldinialanone
SMILES: O=C1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@@H]([C@H](O)CC=C(C)C)C)CC4)(C)CC3)C)=CC2)(C)CC1)(C)C
Compound: 1,4-dihydroxy-2,5-dimethoxy-9,10-anthraquinone
SMILES: O=C1C2=C(C(=O)C=3C1=C(OC)C=CC3)C(O)=C(OC)C=C2O
Compound: Bequinostatin A
SMILES: O=C1C2=C(O)C3=C(C4=C(O)C(=C(CCCCC)C=C4C[C@@H]3O)C(=O)O)C=C2C(=O)C=5C1=C(O)C=C(O)C5
Compound: Pyxidicycline A
SMILES: O=C1C2=C(O)C=3C(=CC(=O)N(C3C)CCO)C=C2C(=O)C=4C1=C(O)C=CC4
Compound: (-)-(1R,6R,7S,10R)-11-oxocadinan-4-en-1-ol
SMILES: O=CC1=C[C@@H]2[C@](O)([C@@H](CC[C@H]2C(C)C)C)CC1
Compound: Paecilomycin M
SMILES: O=C1O[C@H](CC=C[C@H](O)[C@@H]2O[C@H]([C@@H](C=3C1=C(O)C=C(O)C3)O)CC2)C
Compound: Trichocladinol B
SMILES: O=C(OC)[C@]12[C@H](C=C[C@@H]3[C@H]1O[C@](C2O)(O3)C)C
Compound: 6,7-dideoxy-squalestatin H5
SMILES: O=C(O)[C@@]1(O)[C@@]2(O[C@](CC/C(=C/C(CC3=CC=CC=C3)C)/C)(O[C@@H]1C(=O)O)CC2)C(=O)O
Compound: Sydowiol C
SMILES: O(C1=C(OC2=C(O)C(O)=CC(=C2)C)C=C(C)C=C1O)C3=C(O)C=C(C)C=C3O
Compound: Nivetetracyclate B
SMILES: O=C1C2=C(O)C3=C(O)C4=C([C@@H](C(=O)OC)[C@@](O)(CC)CC4)C=C3C=C2[C@H](O)CC1
Compound: Cyclopiamide C
SMILES: O=C1N(C(C)(C)C=2C1=C3C(=O)NC4=C3C(=CC=C4)C2)[C@H](CC(=O)O)C
Compound: Hypogeamicin D
SMILES: O=C1C2=C(O)C=C(OC)C=C2C(=O)[C@]34[C@]1(O3)[C@H](O[C@@H](C4)C(O)C(=O)N)CCC
Compound: Cyclomarazine B
SMILES: O=C1N[C@H](C(=O)N[C@H]1CC=2C3=C(C=CC=C3)N(C2)C(C=C)(C)C)C[C@H](CO)C