MonarchInit/C3PO huggingface dataset:
Compound: Milbemycin alpha26
SMILES: O=C1O[C@@H]2C[C@]3(O[C@@H](C2)CC=C(C[C@H](C=CC=C4[C@]5([C@H]1C=C([C@@H](O)[C@H]5OC4)CO)O)C)C)O[C@@H]([C@@H](C)CC3)C
Compound: Bergofungin
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(CO)CC2=CC=CC=C2)(C)C)CC(C1)O)C(NC(=O)C(NC(=O)C3N(C(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C)C(C)C)(C)C)(C)C)(C)C)C(C)C)CC(C)C)(C)C)(C)C)CC(C3)O)CCC(=O)N)(CC)C
Compound: (11S,15R,17R)-4-hydroxy-17-propyl-12,16,18-trioxapentacyclo[8.7.1.01,10.03,8.011,15]octadeca-3(8),4,6-triene-2,9,13-trione
SMILES: O=C1C2=C(O)C=CC=C2C(=O)C34C1(O3)[C@H](O[C@H]5[C@@H]4OC(=O)C5)CCC
Compound: Bacitracin D1
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@H](CC)C)CCC(=O)O)CC(C)C)[C@@H](N)C(C)C
Compound: S-xenofuranone B
SMILES: O=C1O[C@@H](CC2=CC=CC=C2)C(=C1O)C3=CC=CC=C3
Compound: Cryptoporic acid D
SMILES: O=C1OC[C@]2([C@H]3[C@@]([C@H](C(=C)CC3)CO[C@@H](C(=O)O)[C@@H](C(=O)OC[C@]4([C@H]5[C@@]([C@@H](CO[C@H]([C@@H]1CC(=O)O)C(=O)O)C(=C)CC5)(CCC4)C)C)CC(=O)O)(CCC2)C)C
Compound: Piscicolin-61
SMILES: S(CCC(NC(=O)C(NC(=O)C(N)CC(=O)O)CCC(=O)N)C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)N)CC(C)C)CO)CO)CCCCN)CC1=CC=C(O)C=C1)CC(=O)N)C(C)C)CC(=O)O)CO)C
Compound: Huptremule A
SMILES: O=C1NC2=C([C@]3(NC4OC(=O)C=5C4(OC)CC(O)C(C)C6C5CC(C)(C)C6)/C(=C/C)/[C@H](C2)C=C(C3)C)C=C1
Compound: (-)-blennolide G
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@]6(C1C(O)=C[C@@H](C)[C@H]6O)C(=O)OC
Compound: Lactone II
SMILES: O=C1OC[C@@H]([C@@H]1O)COC(=O)/C=C/[C@H]2O[C@H]2C
Compound: Cryptophycin-43
SMILES: O=C1N[C@@H](C(=O)NC[C@H](C(=O)O[C@H](C(O[C@@H](CC=C1)[C@@H](/C=C/C2=CC=CC=C2)C)=O)CC(C)C)C)CC3=CC=C(O)C=C3
Compound: Trichorovin-VIIa
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)C(C)C)(C)C
Compound: NK-372135 B
SMILES: O(C1=C(OC)C=CC(=C1)/C=C(\[N+]#[C-])/[C@@H]([N+]#[C-])CC2=CC=C(OC)C=C2)C
Compound: 9-Methoxystrobilurin E
SMILES: O=C(OC)/C(/C(=C(/OC)\C=C\C1=CC=2OC3(OC(C=C(C)C)OC3(C)C)COC2C=C1)/C)=C/OC
Compound: Citreohybridone D
SMILES: O=C1C(=C(OC(=O)C)[C@@]2([C@]1(C(=CC3[C@@]4(C=O)C(C([C@@H](OC(=O)C)CC4)(C)C)CC[C@]23C)C)C)C(=O)OC)C
Compound: Agglomerin A
SMILES: O=C1OC(=C)C(=C1C(=O)CCCCCCCCC)O
Compound: 5,6,7,8-tetrahydrofolic acid
SMILES: Nc1nc2NCC(CNc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)Nc2c(=O)[nH]1
Compound: Perenniporide D
SMILES: O=C1O[C@]2(OC)[C@](O)(C3=C(C(O)=C(CC)C(=C3)OC)C(C2)=O)C[C@H]1O
Compound: 2-dodecyl-5-(2-methoxyethyl)-2-methylfuran-3(2H)-one
SMILES: O=C1C=C(CCOC)O[C@]1(CCCCCCCCCCCC)C
Compound: 1-carbomethoxybenzene 1,2-oxide
SMILES: O=C(OC)C12OC1C=CC=C2
Compound: 7-epitsugicoline H
SMILES: O=C(O)C=1OC=C2C1[C@@](O)([C@H]3CC(C)(C)C[C@H]3[C@@H]2O)C
Compound: Desmethylaltenusin
SMILES: O=C(O)C1=C(O)C=C(O)C=C1C2=C(C=C(O)C(=C2)O)C
Compound: Paraphaeosphaeride C
SMILES: O=C1NC(=C)C2=C1[C@H](O)[C@](O)(C)[C@@H](O2)CCCCC
Compound: Vasinfectin A
SMILES: O=C1C2=C(C(=CC(=C2)C(=O)CC)C)OC1(/C=C(/[C@H](O)[C@H](CC)C)\C)C
Compound: Sumalarin A
SMILES: S([C@@H]1CC(=O)C2=C(O)C=C(O)C=C2CC(=O)O[C@H](CCC1)C)C[C@@H](O)C(=O)OC
Compound: Penicisochroman C
SMILES: O=C1C2=C(C3=C(C[C@H](C)O[C@H]3O)C=C2)OC1C(C)C
Compound: Thioplabin C
SMILES: S1C2=NC(=C1)C(=O)NC(C(=O)N/C(/C=3OC=C(N3)C(=O)NCC=4SC=C(N4)C(NC(C5=NC(C(NC(C(NC(C6=NC(C7=C2C=CC(=N7)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)=C)=C)=C)=C)=CO6)=C)=O)=C)=O)=CS5)C)=O)=C/C(C)C)C(O)C
Compound: Cruentaren B
SMILES: O=C1OC(C(C/C=C\CC(O)C(C(O)C(C/C=C\CNC(=O)C(C(O)CCC)C)C)C)C)CC=2C1=C(O)C=C(OC)C2
Compound: Cytochalasin Z(23)
SMILES: O=C1C(=CCC(=O)O[C@]23C(=O)N[C@H]([C@@H]2[C@H](C)[C@@]4([C@H]([C@@H]3C=CC[C@@H]1C)O4)C)CC5=CC=CC=C5)CO
Compound: TPU-0031-B
SMILES: O=C1OC2=C(C=CC(=C2C)O[C@H]3O[C@@H]([C@@H](OC)[C@@H]([C@@H]3O)OC(=O)N)C)C(=C1NC(=O)C4=CC(=C(O)C=C4)CC=C(C)C)O
Compound: Avertoxin D
SMILES: O=C1OC(=C(C)C2=C1C([C@@H](C)O2)(C)C)/C=C/C=C/C=C/[C@H]3O[C@H]4O[C@H](CC)[C@@]([C@]4([C@H]3O)C)(O)C
Compound: 26-hydroxyporicoic acid DM
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(O)(CO)C
Compound: Spirangien B
SMILES: O=C(O)C[C@H](OC)\C=C/C=C/C=C\C=C\C=C/[C@@H]([C@H](O)[C@@H]([C@H]1O[C@]2(O[C@@H]([C@H](C)[C@@H](C2)OC)[C@@H]([C@@H](O)[C@H](C/C(=C/CC)/C)C)C)[C@@H](O)C[C@@H]1C)C)C
Compound: Symplostatin 2
SMILES: S(=O)(CC[C@H](NC(=O)[C@@H](NC(=O)CCC)[C@H](CC)C)C(=O)NC1C(=O)N/C(/C(=O)N[C@@H]2C(=O)N([C@@H](CC3=CC=CC=C3)C(N([C@H](C(N[C@H](C(OC1C)=O)C(C)C)=O)CC4=CC=C(O)C=C4)C)=O)C(O)CC2)=C\C)C
Compound: Phomalairdenone D
SMILES: O=C1C=C[C@@]23[C@@]1(C[C@@](CO)(C)[C@@H]2CC[C@H]3C)C
Compound: Hypogeamicin C
SMILES: O=C1C2=C(O)C=C(OC)C=C2C(=O)[C@@]3([C@]1(O)[C@H](O[C@@H](C3)CC(=O)N)CCC)O
Compound: Saccharothrixmicine B
SMILES: O=C1C2=C(C[C@H](C1)C)CC[C@]3([C@H]2[C@@H](O)C=4C=CC=C(C4[C@@H]3OC5OC(C(O)C(C5O)O)C)OC)O
Compound: Verrucarin X
SMILES: O=C1O[C@H]2[C@@]3([C@@]4([C@@H](C=C(C(=O)O)CC4)O[C@H](C2)[C@]35OC5)COC(=O)[C@@H](O)[C@H](C)CCOC(C=CC=C1)=O)C
Compound: Asperolide A
SMILES: O=C1OCC2=C[C@H]3OC([C@@]4([C@H]3[C@@](C2=C1)([C@H](O)C=C4)C)C)=O
Compound: Epothilone K
SMILES: S1C(=NC(=C1)/C=C(/[C@H]2OC(=O)C[C@H](O)C(C(=O)C(C)CCCC=CC2)C)\C)C
Compound: Macrosphelide A
SMILES: O=C1O[C@H]([C@H](O)C=CC(=O)O[C@@H](C)CC(O[C@H]([C@@H](C=C1)O)C)=O)C
Compound: Halymecin E
SMILES: O=C(O[C@@H](C[C@@H](O)CC(=O)O)CCCC(O)C)C[C@H](O)C[C@H](OC(=O)C[C@H](O)C[C@@H](O)CCCCC)CCCCC
Compound: Bacitracin H1
SMILES: S1C(=NC(=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@H](CC)C)=O)CC3=CC=CC=C3)=O)CC=4NC=NC4)CC(=O)O)CC(=O)N)[C@H](CC)C)CCC(=O)O)CC(C)C)C(=O)C(C)C
Compound: Botryorhodine A
SMILES: O=C1OC2=C(C(=CC(=C2)O)C)OC3=C1C(=CC(=C3C=O)O)C
Compound: Fimsbactin B
SMILES: O=C(OC[C@H](NC(=O)[C@H]1N=C(C2=C(O)C(O)=CC=C2)O[C@@H]1C)C(=O)NCCCCN(O)C(=O)C)C3=C(O)C(O)=CC=C3
Compound: Flocculosin
SMILES: O=C(O)CC(OC(=O)C)CC(OC(=O)C)COC(CO[C@@H]1O[C@@H](C(O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)[C@@H]([C@H]1O)O)CO)CCCCCCCCCCCCCCCC
Compound: 3-chloro-10a-(3-chloro-6-hydroxy-2,2,6-trimethylcyclohexylmethyl)-6,8-di-hydroxy-2,2,7-trimethyl-3,10a-dihydro-2H-benzo[g]chromene-5,10-dione
SMILES: Cl[C@@H]1C=C2C(=O)C3=C(O)C(=C(O)C=C3C([C@]2(C[C@@H]4[C@@](O)(CC[C@@H](C4(C)C)Cl)C)OC1(C)C)=O)C
Compound: Igniaren B
SMILES: O[C@H]1[C@H](C2[C@](C=3C([C@]4([C@]([C@@H]([C@@H]([C@H](O)CC(=C)C(C)C)C)CC4)(C)CC3)C)=CC2)(C)CC1)C
Compound: Hamigeromycin B
SMILES: O=C1O[C@H](C[C@@H]2O[C@H]([C@H](O)C(C2)=O)CC=CC3=C1C(O)=CC(=C3OC)OC)C
Compound: Menaquinone MK-7(VII-H2)
SMILES: O=C1C2=C(C(=O)C(=C1C/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CCCC(C)C)\C)\C)\C)\C)\C)\C)C)C=CC=C2
Compound: Coibamide A
SMILES: O=C1O[C@@H]([C@H](N(C(=O)[C@@H](N(C(=O)[C@@H](N(C(=O)[C@@H](OC(=O)[C@@H](N(C)C)C(C)C)C(C)C)C)COC)C)CC(C)C)C)C(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C(N([C@H](C(N[C@H](C(N([C@H]1C)C)=O)CC2=CC=C(OC)C=C2)=O)CC(C)C)C)=O)C)[C@H](CC)C)C)COC)C)C
Compound: 2,8-dihydroxy-3-methyl-9-oxoxanthene-1-carboxylic acid methyl ester
SMILES: O=C1C2=C(C(O)=C(C)C=C2OC3=C1C(O)=CC=C3)C(=O)OC
Compound: Tenacibactin B
SMILES: O=C(O)CCC(=O)NCCCCCN(O)C(=O)CC(C)C
Compound: (2S)-1-[2-(furan-2-yl)-2-oxoethyl]-5-oxopyrrolidine-2-carboxylic acid
SMILES: O=C1N([C@H](C(=O)O)CC1)CC(=O)C=2OC=CC2
Compound: Lipocarbazole A1
SMILES: OC1=C(C(=C2NC3=C(C2=C1)C=CC=C3)CCCCCCC/C=C\C/C=C\C/C=C\CC)C
Compound: 9′-(2-amino-3-(4′′-O-methyl-alpha-rhamnopyranosyloxy)phenyl)nonanoic acid
SMILES: O=C(O)CCCCCCCCC1=C(N)C(OC2OC(C(OC)C(C2O)O)C)=CC=C1
Compound: 3-Methoxyterprenin
SMILES: O(C1=C(OC)C=C(C2=C(O)C(OC)=C(C3=CC=C(O)C=C3)C=C2OC)C=C1)CC=C(C)C
Compound: Cristatumin D
SMILES: O=C(OC)/C(/NC(=O)C(=O)N)=C/C=1C2=C(C=CC=C2)NC1C(C=C)(C)C
Compound: (E)-6-(2,4-dihydroxyl-5-methylphenyl)-6-oxo-2-hexenoic acid
SMILES: O=C(O)/C=C/CCC(=O)C1=C(O)C=C(O)C(=C1)C
Compound: Malfilanol A
SMILES: O=C(O)C1=C[C@H]2[C@H]([C@](O)(CCC(C2)(C)C)C)CC1
Compound: N-de(phenylethyl)isohericerin
SMILES: O=C1NCC2=C1C=C(OC)C(=C2O)CC=C(CCC=C(C)C)C
Compound: Desacetyltubulysin E
SMILES: S1C(=NC(=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C[C@@H](C(=O)O)C)[C@H](O)C[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H]3N(CCCC3)C)[C@H](CC)C)COC(=O)CCC)C(C)C
Compound: Neoverrucosan-5beta,9beta-diol
SMILES: O[C@@H]1[C@@]2([C@@H]([C@H]3[C@H]4[C@@](C)([C@@H](C[C@@]3(C1)C)O)C4)[C@H](C(C)C)CC2)C
Compound: Lactonamycin Z
SMILES: O=C1C2=C(O)C=3C(=CC(O)=C4C3CN(C)C4=O)C=C2C(=O)C5(C16OC(=O)CC6(OC5)OC)OC7OC(C(O)C(C7)O)C
Compound: (2R,3R,5R,10S,12S,13R,14R,17R)-2,3,12-trihydroxy-4,4,10,13,14-pentamethyl-17-[(2R,5R)-1,5,6-trihydroxy-6-methylheptan-2-yl]-1,2,3,5,6,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-7-one
SMILES: O=C1C2=C([C@]3(C[C@@H](O)[C@@H](C([C@@H]3C1)(C)C)O)C)C[C@H](O)[C@]4([C@]2(CC[C@@H]4[C@H](CO)CC[C@@H](O)C(O)(C)C)C)C
Compound: Erinacerin L
SMILES: O=C1N([C@H](C(=O)O)CC2=CC=CC=C2)CC3=C1C=C(O)C(=C3O)CC/C(=C/CC(=O)OC)/C
Compound: N-hydroxy-6-epi-stephacidin A
SMILES: O=C1N2[C@@]3(C(=O)N[C@@]14[C@@H](C(C=5N(O)C6=C(C5C4)C=CC7=C6C=CC(O7)(C)C)(C)C)C3)CCC2
Compound: 6-hydroxy-3-methylisochroman-5-carboxylic acid
SMILES: O=C(O)C1=C(O)C=CC2=C1C[C@H](C)OC2
Compound: Lusitanic acid
SMILES: O=C1OC2=C(C3=C(C(=O)O[C@@H]3O)C(=C2C)O)OC4=C1C(=CC(=C4C(=O)OC)OC)C
Compound: (R)-3,5-dihydroxy-7-(16-hydroxyheptadecyl)benzoic acid
SMILES: O=C(O)C1=C(O)C=C(O)C=C1CCCCCCCCCCCCCCC[C@H](O)C
Compound: Ganoderic acid GS-3
SMILES: O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3([C@@H]1OC(=O)C)C)[C@@H](CC/C=C(/C(=O)O)\C)C)C)[C@@H](O)C[C@@H]4[C@@]2(CC[C@@H](C4(C)C)O)C
Compound: Erinarol E
SMILES: O=C(O[C@@H]1C[C@@]2(O)[C@]([C@@H]3C([C@H]4[C@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)CC4)(C)CC3)=C[C@@H]2O)(C)CC1)CCCCCCCCCCCCCCCCC
Compound: 2-formyl-3,5-dihydroxy-6-methylbenzoic acid
SMILES: O=C(O)C1=C(C(O)=CC(=C1C)O)C=O
Compound: Virescenoside P
SMILES: O=C1C2=C([C@]3(CC[C@@H]([C@@]([C@@H]3C1)(CO[C@@H]4O[C@@H]([C@@H](O)[C@H]([C@@H]4O)O)CO)C)O)C)CC[C@@](C2)(C=C)C
Compound: (24E)-3,4-hydroxycucurbita-5,24-diene-26-oic acid
SMILES: O=C(O)/C(=C/CC[C@H]([C@@H]1[C@@]2([C@@]([C@H]3[C@@]([C@H]4C(C([C@@H](O)CC4)(C)C)=CC3)(C)CC2)(C)CC1)C)C)/C
Compound: Simple Pyrone 3
SMILES: O=C1OC(=C(C)C(=C1)OC)[C@]2(OC2)C
Compound: n-Butyl lucidenate N
SMILES: O=C1C2=C([C@@]3(CC[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: Antanapeptin C
SMILES: O=C1OC(C(C(=O)N[C@H](C(=O)N([C@@H](CC2=CC=CC=C2)C(O[C@H](C(N3[C@H](C(N([C@H]1C(CC)C)C)=O)CCC3)=O)C(C)C)=O)C)C(C)C)C)CCCCC
Compound: Hamigeromycin E
SMILES: O=C1O[C@H](CCCC(=O)[C@H](O)[C@@H](CC=CC2=C1C(O)=CC(=C2OC)OC)O)C
Compound: Daedaleaside A
SMILES: O=C(O[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@H]1O)O)CO)[C@@H]([C@@H]2[C@@]3([C@@](C4=C(C(=C(C)C=C4)CCC(=O)C(C)C)CC3)(C)C[C@H]2OC(=O)C)C)CCC(=C)C(C)C
Compound: RK-1355A
SMILES: S1(=O)C(SC)C2N(C(=O)C(NC(=O)C(NC(=O)C3=NC=4C(=CC=CC4)C=C3O)COC(C5(N(C(C(C1)N(C(=O)C(NC(=O)C(NC(=O)C6=NC=7C(=CC=CC7)C=C6O)COC(C8(N(C2=O)C)C(C)C8)=O)C)C)=O)C)C(C)C5)=O)C)C
Compound: 11-bromo-17-hydroxyroquefortine C
SMILES: BrC1=CC2=C(NC3[C@@]2(C(C=C)(C)C)C[C@H]4C(=O)N\C(\C(N34)=O)=C(/O)\C=5NC=NC5)C=C1
Compound: Carbazoquinocin D
SMILES: O=C1C(=O)C2=C(NC3=C2C=CC=C3)C(=C1C)CCCC[C@H](CC)C
Compound: Aspergiloid A
SMILES: O=C1C2=C(C=3C=CC(=C4C3[C@@]1(OC[C@H]4O)OC)C)CCCC2(C)C
Compound: Prenylagaramide A
SMILES: O=C1N2[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H]1CC(=O)N)=O)CC3=CC=CC=C3)=O)CC4=CC=CC=C4)=O)CCC(=O)O)=O)[C@H](O)C)CC5=CC=C(OCC=C(C)C)C=C5)CCC2
Compound: Austrocortinin 8-O-beta-D-gentiobioside
SMILES: O=C1C2=C(O)C(OC)=CC(=C2C(=O)C3=C1C=C(C)C=C3)O[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO[C@@H]5O[C@@H]([C@@H](O)[C@@H]([C@H]5O)O)CO
Compound: Altenin
SMILES: O=C1C(OC(C1)C(=O)OCC)(O)C(O)C
Compound: Malleobactin C
SMILES: O=NCCC[C@H](NC=O)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCCCCN)CCCN(O)C=O)CO)[C@@H](O)C(=O)O
Compound: Xanthoquinodin B4
SMILES: O=C1C2=C(O)C3=C(O)C=C(C)C=C3[C@@H]([C@]24C=C[C@H]1C5=C6O[C@]7(C(C(=O)CC[C@@H]7O)=C(C6=C(O)C=C5C4)O)C(=O)OC)O
Compound: Tyromycic acid E
SMILES: O=C(O)/C(=C\CC[C@H](C1C(=C)C2C=C3[C@@]4([C@H](C([C@@H](O)CC4)(C)C)CC=C3[C@]2(C)CC1)C)C)/C
Compound: Pyripyropene C
SMILES: O=C1OC(C2=CN=CC=C2)=CC3=C1C(O)C4C5(C(C(C(OC(=O)C)CC5)(COC(=O)C)C)CC(C4(O3)C)OC(=O)CC)C
Compound: Saccharothrixone D
SMILES: O=C1C2=C(O)C=3C(=CC(OC)=C(C3C)C(=O)OC)C=C2C(=O)[C@]4([C@]1(O)C(OC)=CC(=O)[C@@H]4OC)O
Compound: Pyrenoline B
SMILES: O=C1C2=C(O)C=3C(=CC(C)=NC3)C=C2[C@@H](O)CC1
Compound: Salinipostin I
SMILES: [P@]1(=O)(OC(=C2C(=O)OC[C@H]2CO1)CC)OCCCCCCCCCCCCCCC
Compound: Brevianamide R
SMILES: O=C/1N2[C@@](OC)(C(=O)N\C1=C/C=3C4=C(C=CC=C4)NC3C(C=C)(C)C)CCC2
Compound: K-582-B
SMILES: O=C(O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(N)CCCCN=C(N)N)CC(O)CCN=C(N)N)CCCN)C(O)C)CCCN)CC(O)CCN=C(N)N)CC1=CC=C(O)C=C1
Compound: 3-epi-astrapteridiol
SMILES: O1[C@H](O)[C@H](CC[C@H]1[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)C)C
Compound: Thalabetaospiramide A1
SMILES: O=C1N[C@H](C(=O)N([C@H](C(=O)OC[C@@H](C=C1)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C/C=C\CCCCCC)CC2=CC=C(O)C=C2)C(C)C)CO)C(C)C)CC3=CC=C(O)C=C3)C)C(C)C
Compound: Ophiobolin P
SMILES: O=C1O[C@]2(O)C[C@](O)(C)[C@@H]3[C@@H]2C1=CC[C@@H]4[C@@](CC[C@@H]4[C@H](/C=C\C=C(C)C)C)(C)C3
Compound: Violascensol
SMILES: O=C1C2=C(C[C@@H]3C[C@](C[C@@H]3[C@@]2(C)C1)(CO)C)C
Compound: 2,2-bis(3,3'-indolyl)-isocaproic acid
SMILES: O=C(O)C(C=1C2=C(C=CC=C2)NC1)(C=3C4=C(C=CC=C4)NC3)CC(C)C
Compound: Dhilirolide D
SMILES: O=C1OC(C2=CC[C@]3(C([C@](C2=C1)(O)C)C[C@]4(C(=O)[C@]5([C@]3(C(=O)O[C@H]5C)C4=C)O)C)C)(C)C
Compound: 7-demethyl A80915B
SMILES: Cl[C@@]12C(=O)C3=C(C(=[N+]=[N-])C(=O)C=C3O)C([C@@]1(OC(C)(C)[C@@H](C2)Cl)C[C@@H]4C(=C)CC[C@@H](C4(C)C)Cl)=O
Compound: [D-Leu1]microcystin-LR
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](CCCN=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)CC2=CC=CC=C2)C)/C)=O)C)CC(C)C)CC(C)C
Compound: Heptemerone F
SMILES: O=C1C=2C3=C([C@]4(O)C(=O)[C@H](OC(=O)C)[C@@H]([C@@]4(C)CC[C@]3(C)CC1)C(C)C)OC2
Compound: Neopyrrolomycin D
SMILES: ClC1=C(Cl)C=C(N2C(Cl)=C(Cl)C(=C2)Cl)C(=C1)O
Compound: 5,6-dioxidoindole-2-carboxylate
SMILES: [O-]C(=O)c1cc2cc([O-])c([O-])cc2[nH]1
Compound: Juglomycin Z
SMILES: O=C1C2=C(C(=O)C(=C1C[C@H](O)CC(=O)O)C)C(O)=CC=C2
Compound: Penicillixanthone
SMILES: ClC1=C2OC3=C(C(C(=O)OC)=CC(=C3)O)C(C2=C(O)C(=C1C)Cl)=O
Compound: Cucumin B
SMILES: O=C1C2=CC3=CC(=O)[C@@H]([C@]3([C@@H]2CC1(C)C)C)C
Compound: 10-beta-hydroxy CAF-603
SMILES: O[C@]1([C@@H]2[C@@]([C@@H](O)C=C(CC2)C)(C)C[C@H]1O)C(C)C
Compound: 4alpha,11,12,14-tetrahydroxy-1-tremulene
SMILES: O[C@@H]1[C@@H](C(=C2C[C@](CO)(C)C[C@H]2[C@H](C1)C)CO)CO
Compound: Speciosin S
SMILES: O=C(OC/C(=C/C[C@H]1[C@@H](O)CC[C@@H](C1)O)/C)C
Compound: Guanacastepene O
SMILES: O=C1OC2=C3C(=O)[C@@H](OC(=O)C)[C@@H]([C@]3(CC[C@]4(C2=C1[C@@H](O)CC4)C)C)C(C)C
Compound: Hericenone G
SMILES: O=C(OCC1=C(C=2O[C@](CCC2C(=C1)OC)(CC(=O)C=C(C)C)C)C=O)CCCCCCCCCCCCCCCCC
Compound: Cis-4-hydroxy-6-deoxyscytalone
SMILES: O=C1C2=C(O)C=CC=C2[C@H](O)[C@@H](C1)O
Compound: Nosokomycin D
SMILES: P(=O)(O[C@H]1O[C@H](C(=O)N)[C@](O)(C)[C@@H]([C@H]1O[C@@H]2O[C@@H]([C@@H](O[C@@H]3O[C@@H]([C@@H](O[C@@H]4O[C@H](C(=O)N)[C@@H](O)[C@@H]([C@H]4O)O)[C@@H]([C@H]3NC(=O)C)O)C)[C@@H]([C@H]2NC(=O)C)O)CO)OC(=O)N)(OC[C@@H](OC/C=C(\C/C=C/CC(CCC(=C)C/C=C(/CCC=C(C)C)\C)(C)C)/C)C(=O)O)O
Compound: (E)-4-[(1R,2S,4S,11R,12S,13R,16S,18S,19S,22S)-4-[(E)-3-carboxybut-2-enyl]-19-hydroxy-3,7,15-trioxo-11,22-dipentyl-5,10,17,21-tetraoxaheptacyclo[11.7.2.02,8.02,12.04,6.014,20.016,18]docosa-8,14(20)-dien-16-yl]-2-methylbut-2-enoic acid
SMILES: O=C1C2=C([C@H]3O[C@H]([C@@H]2[C@@H]4[C@H](OC=C5[C@]34C(=O)[C@]6(OC6C5=O)C/C=C(/C(=O)O)\C)CCCCC)CCCCC)[C@H](O)[C@H]7[C@@]1(O7)C/C=C(/C(=O)O)\C
Compound: Penicitrinone A
SMILES: O=C1C(=C2C3=C(O[C@@H]([C@H]2C)C)C=4C(O)=C(C)C5=C(C4OC3=C1)O[C@H](C)[C@H]5C)C
Compound: Pseudoaeruginosin KT554
SMILES: O=C(N[C@@H](C(=O)N[C@H](C(=O)NCCCCN=C(N)N)CC1=CC=CC=C1)CC(C)C)[C@H](O)CC2=CC=C(O)C=C2
Compound: 2-methyl-heptyl isonicotinate
SMILES: O=C(OC[C@H](CCCCC)C)C1=CC=NC=C1
Compound: Gibellulin B
SMILES: O1C2=C(OC3=C1C(=CC(=C3O)O)C)C=C(C)C=C2O
Compound: Merochlorin D
SMILES: Cl[C@]1(C(=O)C2=C(O)C=C(O)C=C2C([C@@]1(O)CC(=C(C)C)CC=C(CCC=C(C)C)C)=O)C
Compound: Salinipostin J
SMILES: [P@]1(=O)(OC(=C2C(=O)OC[C@H]2CO1)CC)OCCCCCCCCCCCCCC
Compound: Patientoside B
SMILES: O=C1C2=C(O)C=C(OC)C=C2[C@@](O)([C@@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)O)CO)C=4C1=C(O)C=C(C)C4
Compound: Sequoiamonascin D
SMILES: O=C1C=2C(=C(C(=O)OC)C=3[C@]1(OC(=O)C3C(=O)[C@@H](CCCCCC)C)C)C=C(C)N(C2)CCO
Compound: Illudolactone B
SMILES: O=C1OC2=C(CC(C2)(C)C)[C@@]3(C(=C1CO)C=C3)C
Compound: Harzianumol E
SMILES: O[C@H]([C@H](O)CC/C=C/C)CC/C=C/C=C
Compound: Histomodulin
SMILES: O=C1C2=C(O)C3=C([C@@H](C(=O)OC)[C@@](O)(CC)C[C@@H]3O)C(=C2C(=O)C=4C1=C(OC5OC(C(=O)O)C(O)C(C5O)O)C=CC4)O
Compound: Hygrophorone D
SMILES: O=C1C=C[C@H]([C@@]1(O)C(=O)CCCCCCCCCCCC)O
Compound: (1R,4S,5R,7R,10R)-guaiane-1,5,10,11,12-pentaol
SMILES: O[C@]1([C@@]2(O)[C@](O)([C@@H](C)CC2)C[C@@H](CC1)C(O)(CO)C)C
Compound: alpha-D-glucopyranuronosyl-(1->3)-alpha-l-rhamnopyranosyl-(1->2)-alpha-l-rhamnopyranose
SMILES: O1C(OC2C(O)C(OC(C2O)C)OC3C(OC(C)C(C3O)O)O)C(O)C(O)C(C1CO)O
Compound: Penisimplicin B
SMILES: O=C1[C@@](OC(=O)[C@@H]2[C@@]1(C(=C)C[C@@H]3[C@@]4([C@H](C(C(=O)CC4)(C)C)C[C@@H]([C@@]23C)OC(=O)C)C)C)(C(=O)OC)C
Compound: Cytochalasin Z25
SMILES: O=C1O[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C(=C[C@@H]3C=CC[C@@H](C([C@@H](C=C1)C)O)C)C)CC4=CC=C(O)C=C4
Compound: Kutzneride 1
SMILES: ClC1=C(Cl)C=CC2=C1N[C@H]3N4C(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H]5N(NCCC5)C([C@@H](OC([C@H](NC([C@@H]4C[C@@]23O)=O)C6(CC6)C)=O)C(C)(C)C)=O)COC)[C@@H](O)CC(=O)O
Compound: Penicimutanin B
SMILES: O=C1N2[C@@H]3N(C=4C=CC=CC4[C@]3(C(C=C)(C)C)C[C@H]2C(=O)N[C@H]1CC5=CC=C(O)C=C5)[C@H]6OC7([C@H]8O[C@H]8C(O)(CC(=O)C)[C@@H]9[C@H]7O9)C[C@@H]6NC(=O)/C=C/C(CC(CCCCCC)C)C
Compound: Cytochalasin Z11
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@]1(O)[C@@H](/C=C/C[C@@H](C(=O)[C@@H](O)C)C)[C@H](O)C(=C)[C@H]3C
Compound: Squalestatin S8
SMILES: O=C(O[C@H]1[C@]2(O[C@@]([C@@H]1O)(O[C@@H]([C@@]2(O)C(=O)O)C(=O)O)CC/C(=C\C(CC3=CC=CC=C3)C)/CNC(=O)C)C(=O)O)/C=C/[C@H](C[C@H](CC)C)C
Compound: Oblongolide J
SMILES: O=C1OCC=2[C@]1([C@@H]3[C@H](C[C@@H](C)CC3)[C@H](C2)O)C
Compound: Guignardone F
SMILES: O=C1C2=C(OC(C)(C)[C@H]3[C@H](C2)[C@](O)(CC3)C)[C@@H]4C[C@@]1(O)CO4
Compound: Sannanine
SMILES: O=C1C(NC)=CC(=O)C2=C1C=C(C)C(=N2)C
Compound: Dehydromonacolin N
SMILES: O=C1O[C@@H](CC=C1)CC[C@@H]2[C@@H]3C(C=C[C@@H]2C)=C[C@H](C)C[C@@H]3OC(=O)C
Compound: Ganolucidate F
SMILES: O=C1C2=C([C@@]3([C@@H](O)C[C@@H]([C@]3(C1)C)[C@@H](CC(O)C=C(C(=O)O)C)C)C)CCC4[C@@]2(CC[C@@H](C4(C)C)O)C
Compound: Malyngamide R
SMILES: Cl/C=C(\CN(C(=O)CC/C=C/C[C@@H](OC)CCCCCCC)C)/C/C(/OC)=C\C(=O)N1C(=O)C=C([C@H]1CO)OC
Compound: Dendryol E
SMILES: O=C1C2=C(C(O)=CC(=C2)C)[C@@H](O)[C@H]3[C@H]1C[C@H](O)CC3
Compound: 7-O-(alpha-glucosyl)-2,3-dihydrocineromycin B
SMILES: O=C1O[C@@H]([C@H](CCC=C(C)[C@H](C=C[C@](CC1)(O)C)O[C@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)C)C
Compound: Y-lactone 2
SMILES: O=C1OC[C@](C1)(O)CC(=O)OC
Compound: Inonoblin B
SMILES: O=C1OC(C2=CC=3C=C(O)C(=CC3[C@]2(O)C(=O)C)O)=CC4=C1C5=C(C=C(O)C(=C5)O)C(O4)=O
Compound: 3beta-hydroxyl-(22E, 24R)-ergosta-5,8(14),22-trien-7,15-dione
SMILES: O=C1C2=C3C(=O)C[C@@H]([C@]3(CC[C@@H]2[C@]4(CC[C@@H](CC4=C1)O)C)C)[C@@H](/C=C/[C@@H](C(C)C)C)C
Compound: Chloropestolide A
SMILES: Cl[C@@]12C(OC)=C[C@@](C(=O)OC)([C@]3(C1=O)OC(=O)C=4C(O)=CC(=CC4O3)C)C[C@@]2(C=C=C5[C@@H](O)[C@]6(O[C@H]6[C@H](C5)O)CC=C(C)C)C
Compound: 29-hydroxypolyporenic acid C
SMILES: O=C1[C@@]([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@H](C(=O)O)CCC(=C)C(C)C)[C@@H](C4)O)(C)CC3)C)=CC2)(C)CC1)(CO)C
Compound: Epispaeropsidone
SMILES: O=C1C=C(OC)[C@H](O)[C@@H]2[C@H]1O2
Compound: Fumiquinazoline B
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@H](NC([C@H]2C[C@]4(O)C5=C(C=CC=C5)N6C4N[C@@H](C)C6=O)=O)C
Compound: Dankamide
SMILES: O=C(N)C=CC(=C[C@@H](CC(=O)O)C)C
Compound: Elfvingic acid F
SMILES: O=C1C=C2[C@@]3(C(C([C@@H](O)CC3)(C)C)C[C@H]4[C@@]2(O4)[C@]5([C@]1(C(=C[C@H]5O)C(O)(CC(=O)CC(C(=O)O)C)C)C)C)CO
Compound: Ganoderic acid T-Q
SMILES: O=C1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@@H](CC/C=C(/C(=O)O)\C)C)C[C@@H]4OC(=O)C)(C)CC3)C)=CC2)(C)CC1)(C)C
Compound: Coniothyrione
SMILES: ClC1=CC=2OC=3C=CC=C(C3C(C2[C@]1(O)C(=O)OC)=O)O
Compound: (16S)-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: Rulepidadiene B
SMILES: C12=CC=C[C@@H]([C@@]1([C@H](CCC2)C)C)C(=C)C
Compound: Paraphaeosphaeride B
SMILES: O=C1C=2C(=O)N=CC2O[C@H]([C@@]1(O)C)CCCCC
Compound: Aigialomycin E
SMILES: O=C1O[C@@H](CC=C[C@@H](O)[C@@H](O)CCC=CC=2C1=C(O)C=C(O)C2)C
Compound: Bromoalterochromide A
SMILES: BrC1=C(O)C=CC(=C1)/C=C/C=C/C=C/C=C/C(=O)NC2C(=O)NC(C(=O)NC(C(=O)NC(C(NC(C(OC2C)=O)C(CC)C)=O)CC(=O)N)CC(=O)N)C(C)C
Compound: Cavoxinone
SMILES: O=C1C2=C(O[C@@H](C1)C=CCCC)C=C(CC(=O)O)C=C2OC
Compound: Acremonol
SMILES: O=C1O[C@H](CC[C@H](O)C=CC(O[C@H](C(C=C1)=O)C)=O)C
Compound: (+)-rugulosin A
SMILES: O=C1C2=C(C(O)=C3C14C5C(=O)C6=C(O)C=7C(O)=CC(=CC7C(C86C(C4[C@H](O)C8C3=O)[C@@H]5O)=O)C)C(O)=CC(=C2)C
Compound: MK-8
SMILES: O=C1C2=C(C(=O)C(=C1CC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(C)C)C)C)C)C)C)C)C)C)C=CC=C2
Compound: 13-Hydroxyglucopiericidin A
SMILES: O=C1C(OC)=C(OC)NC(=C1C)C/C=C(/C/C=C/C(=C/C(C(OC2OC(C(O)C(C2O)O)CO)/C(=C/CO)/C)C)/C)\C
Compound: Bacitracin B1
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@H](CC)C)=O)CC3=CC=CC=C3)=O)CC=4NC=NC4)CC(=O)O)CC(=O)N)[C@H](CC)C)CCC(=O)O)CC(C)C)[C@@H](N)C(C)C
Compound: (1R,3R,4R,5S,7R,10R,11R)-guaiane-3,10,11,12-tetraol
SMILES: O[C@]1([C@H]2[C@H]([C@@H](C)[C@@H](C2)O)C[C@@H](CC1)C(O)(CO)C)C
Compound: Ganoderic acid GS-1
SMILES: O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3(C1)C)[C@@H](CC/C=C(/C(=O)O)\C)C)C)[C@@H](O)C[C@@H]4[C@@]2(CCC(C4(C)C)=O)C
Compound: Clavicoronic acid
SMILES: O=C(O)C(=O)C=1C(=C[C@@H]2CC(C[C@@H]2C1C)(C)C)C=O
Compound: Integracide B
SMILES: O=C(O[C@@H]1[C@]2(C(C=3CC[C@@H]4[C@@](C3[C@H]1O)(C[C@@H](O)[C@@H](C4(C)C)O)C)=CC[C@@H]2[C@@H](CCC(=C)C(C)C)C)C)C
Compound: Ganoderique acid W
SMILES: O=C(O)/C(=C/CC[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4(C(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-[(methoxythio)carbonyl]pyridine-2-monothiocarboxylic acid S-methyl ester
SMILES: S(OC)C(=O)C1=NC(C(SC)=O)=CC=C1
Compound: Taxlllaid B
SMILES: O=C1O[C@@H]([C@H](NC(=O)CCCC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(N[C@@H](C(N[C@H](C(N[C@H]1C)=O)CC(C)C)=O)CC(C)C)=O)CC(C)C)CC2=CC=C(O)C=C2)C)C
Compound: 8,9-dihydrolactimidomycin
SMILES: O=C1O[C@@H](/C(=C/[C@@H](C(=O)C[C@H](O)CC2CC(=O)NC(C2)=O)C)/C)[C@H](CCC=CCCC=C1)C
Compound: Cosmosporaside E
SMILES: O=C(O[C@@H]1[C@@H](O[C@H](CO)[C@H]([C@@H]1O)O)OC(C(O)(CCC=C(C)C)C)CC(OC(=O)C)C(=CCO[C@@H]([C@H](O)[C@H](O)CO)[C@H](O)CO)C)CC/C=C\CCCCC
Compound: Gliocladine A
SMILES: S1S[C@@]2(N(C)C([C@]3(S1)N([C@H]4NC=5C=CC=CC5[C@]4([C@@H]3O)C67C8=C(C=CC=C8)N[C@@H]6N9C(=O)[C@]%10(C)SS[C@@]9([C@H]7O)C(=O)N%10C)C2=O)=O)C
Compound: Micropeptin MZ859
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@H](O)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)OC)CCCN=C(N)N)C
Compound: Gallicynoic acid C
SMILES: O=C(O)CCCCC/C=C\[C@H](O)C#C[C@H](O)CCCC
Compound: Cortistatin F
SMILES: O1[C@@]23C(C=C4[C@]1(C[C@H](N(C)C)C=C4)CC2)=CC[C@]5([C@H]3CC[C@@H]5C(CCC6C(CN(C)CC6)C)C)C
Compound: Awajanoran
SMILES: O1C2=C(C(=CC(=C2)OC3=CC(O)=CC(=C3)C)C)C[C@H]1C(O)(C)C
Compound: Spirodienal
SMILES: O=C/C=C/C=C\C(C(O)C([C@H]1O[C@]2(O[C@@H]([C@H](C)[C@@H](C2)OC)C(C(O)C(C/C(=C/C)/C)C)C)[C@@H](O)C[C@@H]1C)C)C
Compound: (aR)-2'-methoxyvinaxanthone
SMILES: O=C1C(=C(OC=2C1=C(C(O)=C(O)C2)C(=O)O)OC)C3=C(C=4OC5=C(C(=C(O)C(=C5)O)C(=O)O)C(C4C=C3C(=O)C)=O)C(=O)C
Compound: Spiromastixone O
SMILES: ClC1=C2OC3=C(Cl)C(O)=C(Cl)C(=C3C(OC2=C(CCC)C(=C1O)Cl)=O)CCC
Compound: MS-681b
SMILES: O=C(N[C@H](CNCCCNCCCCN)CC1=CC=CC=C1)[C@@](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@](NC(=O)[C@@H](NC(=O)C(NC(=O)C(NC(=O)[C@@H](NC(=O)C)CC2=CC=CC=C2)(C)C)(C)C)C)(CC)C)CC3=CC=CC=C3)(CC)C
Compound: Polanrazine B
SMILES: S([C@]1(NC(=O)[C@](SC)(CC=2C3=C(C=CC=C3)NC2)NC1=O)C(C)C)C
Compound: (4S)-4,5-dihydro-4-hydroxygeldanamycin
SMILES: O=C1NC=2C(=O)C(=C(OC)C(C2)=O)C[C@H](C[C@H](OC)[C@H](O)[C@H](C=C([C@@H]([C@H](C[C@@H](C=C1C)O)OC)OC(=O)N)C)C)C
Compound: Iturin A-7
SMILES: O=C1N2[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]1CCC(=O)N)=O)CC(=O)N)=O)CC3=CC=C(O)C=C3)=O)CC(=O)N)=O)CCCCCCCCCCCCC)CO)CC(=O)N)CCC2
Compound: (3S,4S)-6-[(3S,4S)-4,10-dihydroxy-7,9-dimethoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromen-5-yl]-9-methoxy-3-methyl-3,4-dihydro-1H-benzo[g]isochromene-4,7,10-triol
SMILES: O1[C@H]([C@@H](O)C2=C(C3=C(O)C=C(OC)C=4C3=CC=5[C@H](O)[C@H](C)OCC5C4O)C6=CC(OC)=CC(=C6C(=C2C1)O)OC)C
Compound: 2-(2-(3-hydroxy-1-(1H-indol-3-yl)-2-methoxypropyl)-1H-indol-3-yl) acetic acid
SMILES: O=C(O)CC=1C2=C(C=CC=C2)NC1[C@@H](C=3C4=C(C=CC=C4)NC3)C(OC)CO
Compound: 7-deoxy-13-dihydrodaunomycinon
SMILES: O=C1C2=C(O)C3=C(C[C@@](O)(C(O)C)CC3)C(=C2C(=O)C=4C1=C(OC)C=CC4)O
Compound: Pestalol B
SMILES: O=CC1=C(O)C=CC(=C1C=CCCC[C@@H](O)C)CC=C(C)C
Compound: Arecoic acid B
SMILES: O=C(O)[C@@]1([C@H]2[C@]([C@@H](C(=O)O)[C@@](O)(C)[C@@H](C2)O)(CCC1)C)C
Compound: Cryptoporic acid J
SMILES: O=C1OC[C@]2([C@H]3[C@@]([C@H](C(=C)CC3)CO[C@@H](C(=O)OC)[C@@H](C(=O)OC[C@]4([C@H]5[C@@]([C@@H](CO[C@H]([C@@H]1CC(=O)OC)C(=O)OC)C(=C)CC5)(CCC4)C)C)CC(=O)O)(CCC2)C)C
Compound: Chartarlactam D
SMILES: O=C1NCC2=C1C=C(O[C@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)O)CO)C4=C2O[C@]5([C@@]6([C@H](C([C@H](O)CC6)(C)C)CC[C@H]5C)C)C4
Compound: F13459
SMILES: O=C1OC(O)(C(OC(=O)CC/C(=C/CC2=C(OC)C(=C3COC(C3=C2O)=O)C)/C)C=4C1=C(O)C=C(O)C4)C
Compound: Scopularide A
SMILES: O=C1O[C@H](C(CCCCCC)C)CC(=O)NCC(=O)N[C@@H](C(C)C)C(N[C@@H](C(N[C@H](C(N[C@H]1CC2=CC=CC=C2)=O)C)=O)CC(C)C)=O
Compound: Tricycloalternarene I
SMILES: O=C1C2=C(O[C@@]3(CC[C@H]([C@@H]3C2)[C@@](O)(CCC=C(C)C)C)C)CC[C@H]1O
Compound: Militarinone F
SMILES: O=C1N(O)C=C(C23OC(CC2)CC3)C(=C1C(=O)/C=C/C=C/C(=C/C(CC(CC)C)C)/C)O
Compound: 8-epi-ophiobolin J
SMILES: O=C1C2=C([C@H](O)C[C@H]3[C@]4(O[C@@H](C=C(C)C)C[C@@H]4C)CC[C@@]3(C[C@@H]2C(=C1)C)C)CO
Compound: Diatretyne 3
SMILES: O=C(O)/C=C/C#CC#CC#CCO
Compound: Chaetophenol E
SMILES: O=C1C(=C2C=C(OC[C@@]23CC=4C(=C(CC=C(C)C)C(=C(C4O[C@]3([C@@H]1C)O)C)O)CC(=O)C)C)CC=C(C)C
Compound: Monaspyranoindole
SMILES: O1C(C=2NC=3C=CC=CC3C2CC1)(C)C
Compound: Gulmirecin B
SMILES: O=C1OC(C(=CC)C)CC=C(C(OC2OC(CO)C(C2O)O)C(C(CCC1C)=O)O)C
Compound: Propeptin
SMILES: O=C1N2C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CC3=CC=C(O)C=C3)C(NC(C(NC(CC(NCC(NC1CC4=CC=C(O)C=C4)=O)=O)C(=O)NC(C(=O)NC(C(=O)NCC(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N5C(C(=O)O)CCC5)CO)C(CC)C)CC6=CC=CC=C6)C(O)C)CC=7N=CNC7)CC8=CC=CC=C8)CC(C)C)=O)CCCNC(=N)N)=O)CC(=O)O)CC=9C%10=C(C=CC=C%10)NC9)CC=%11C%12=C(C=CC=C%12)NC%11)CCC2
Compound: 12beta-Acetoxy-7beta-hydroxy-3,11,15,23-tetraoxo-5alpha-lanosta-8,20-dien-26-oic acid
SMILES: O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3([C@@H]1OC(=O)C)C)/C(=C\C(=O)CC(C(=O)O)C)/C)C)[C@@H](O)C[C@@H]4[C@@]2(CCC(C4(C)C)=O)C
Compound: Citrantifidiene
SMILES: O=C(O/C(=C/C=C(/OC(=O)C)\CCO)/CCO)C
Compound: Trichocarane B
SMILES: O[C@@]1([C@H]2[C@](CC=C(CC2)CO)(C)C[C@@H]1O)C(C)C
Compound: Armochaetoglobin J
SMILES: O=C1C(=O)CCC(=O)[C@@]23C(=O)N[C@]4([C@@H]2[C@H](C)[C@]([C@H]([C@@H]3C=CC[C@@H](C=C1C)C)O)(C)O4)CC=5C6=C(C=CC=C6)NC5
Compound: Precorallopyronin A
SMILES: O=C1OC(=CC(=C1C(=O)C(=CC=C(CCC/C(=C\CC=CC)/C)C)C)O)[C@@H](CCC=CNC(=O)OC)C
Compound: Hexacyclinic acid
SMILES: O=C1O[C@H]2[C@@H](C)[C@@]3([C@H]1[C@H]4[C@@H]5[C@H]6[C@H](O)[C@@H](C)[C@@H]([C@H]6C=C([C@H]5C[C@H]4[C@@](O3)(C)CC2)C(=O)O)OC(=O)C)O
Compound: (3S,3'R)-3'-(4-oxoquinazolin-3-yl)spiro[1H-indole-3,5'-oxolane]-2,2'-dione
SMILES: O=C1N(C=NC2=C1C=CC=C2)[C@H]3C(=O)O[C@]4(C3)C(=O)NC5=C4C=CC=C5
Compound: Lucidenic acid D
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@@]4(CC([C@@H]([C@]4(C1=O)C)[C@@H](CCC(=O)O)C)=O)C
Compound: Kandenol C
SMILES: O=C1C=C([C@]2(OO)C[C@@H](C(O)(C)C)[C@@H](C[C@]2(C1)C)O)C
Compound: BU-4794F
SMILES: O=C(O[C@@H]1[C@@H](O)[C@]2(O[C@@H]([C@H]1O[C@@H]3OC([C@H](O)[C@@H]([C@H]3O)O)COC(=O)/C=C/C=C/C=C/CCC)CO)OCC=4C2=C(O)C=C(O)C4)/C=C/C=C/CC(O)/C=C/C=C/C=C/CCC
Compound: 2-(3-carboxy-2-hydroxypropyl)-3-methyl-2-cyclopentenone
SMILES: O=C1C(=C(C)CC1)C[C@@H](O)CC(=O)O
Compound: Gephyronic acid (hemiketal)
SMILES: O=C(O)C[C@@H]1O[C@](O)(C(C)(C)[C@H]([C@@H]1C)OC)[C@H](C[C@@H]([C@H](O)[C@]2(O[C@@H]2[C@H](C=C(C)C)C)C)C)C
Compound: Methoxy-macrolactin 1
SMILES: O=C1O[C@@H](CCCC=CC=C[C@H](OC)C[C@@H](O)CC=CC=C[C@H](CC=CC=C1)O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)C
Compound: Arizonin B1
SMILES: O=C1C2=C(O)C(OC)=CC=C2C(=O)C3=C1C(OC4C3OC(=O)C4)C
Compound: Phomazine B
SMILES: S([C@]1(NC(=O)[C@]2(SC)CC=3[C@H](N2C1=O)[C@@H](O)C=CC3)CC4=CC=CC=C4)C
Compound: Menaquinone MK-5(V-H2)
SMILES: O=C1C2=C(C(=O)C(=C1C/C=C(/CC/C=C(/CC/C=C(/CC/C=C(/CCCC(C)C)\C)\C)\C)\C)C)C=CC=C2
Compound: Communesin H
SMILES: O=C(N1[C@H]2N3[C@H](C=4C=CC=C5C4[C@]6([C@@]2(C7=C(N[C@H]6N5C)C=CC=C7)CC1)CC3)[C@@H]8OC8(C)C)CCC
Compound: Phyllostictine C
SMILES: O=C1N(OC)C(=C)C2=C1[C@H](O)[C@](O)(CO)[C@@H](O2)CCCCCCC
Compound: T988 B
SMILES: S([C@@]1(N(C(=O)[C@@]2(SC)[C@@H](O)[C@]3([C@@H](N2C1=O)NC=4C=CC=CC34)C=5C6=C(C=CC=C6)NC5)C)CO)C
Compound: Cathestatin C
SMILES: O=C(O)[C@H]1O[C@@H]1C(=O)N[C@H](C(=O)NCCCCCN)CC2=CC=C(O)C=C2
Compound: Methoxy-macrolactin 2
SMILES: O=C1O[C@@H](CCCC(OC)C=CC=CC[C@@H](O)CC=CC=C[C@H](CC=CC=C1)O[C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)C
Compound: COB1
SMILES: O=C(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](N)C(C)C)C)C(C)C)CC(C)C)C(C)C)CC(C)C)C
Compound: Sclerominol
SMILES: O=C/1N(O)C(=O)C(CC2=CC=CC=C2)=N\C1=C/C3=CC=CC=C3
Compound: Mitibetaimolone
SMILES: O=C1[C@@H](C=C(C)C)[C@@]2([C@@H](O[C@@H](C2)O)[C@H](C[C@H]1C)O)C
Compound: 2a,9a,11-trihydroxy-6-oxodrim-7-ene
SMILES: O=C1C=C(C(O)(CO)[C@@]2([C@@H]1C(C[C@@H](C2)O)(C)C)C)C
Compound: Aeruginoside 126B
SMILES: O=C(NCCCCN=C(N)N)[C@H]1N(C(=O)[C@H](NC(=O)[C@H](O)CC2=CC=CC=C2)CC(C)C)[C@H]3C[C@H](O[C@H]4OC[C@@H](O)[C@@H]([C@H]4O)O)CC[C@H]3C1
Compound: Terreumol B
SMILES: O=C1C2=C(O)C=C(OC)C(=C2C[C@@]3(O[C@@H]3[C@H](C[C@@]4([C@@H]1O4)C)O)C)O
Compound: N-desmethyl 11-acetoxy pretubulysin D
SMILES: S1C(=NC(=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C[C@@H](C(=O)O)C)[C@H](OC(=O)C)C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]3N(CCCC3)C)[C@H](CC)C)C(C)C
Compound: Helminthosporic acid
SMILES: O=C(O)C1=C([C@@]2(CC[C@@H]([C@H]1C2CO)C(C)C)C)C
Compound: Nodulisporipyrone A
SMILES: O=C1OC(=CC(=C1)OC)[C@H](O)CCCCCC
Compound: Micropeptin EI992
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)CCC)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]1[C@H](CC)C)=O)CC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CCCN=C(N)N)C
Compound: Lecanindole C
SMILES: O=C1C=CC2(C3(C=4NC=5C=C(O[C@@H]6O[C@@H]([C@@H](OC)[C@@H]([C@H]6O)O)CO)C=CC5C4CC3CCC2C1(C)C)C)C
Compound: Aeruginazole DA1497
SMILES: S1C2=NC(=C1)C(=O)N[C@@H](C(=O)N[C@H](C=3SC=C(N3)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C=4SC=C(C(NCC(N5[C@H](C(N[C@H](C6=NC(C(N[C@H](C(NCC(N7[C@H](C(N[C@H]2C(C)C)=O)CCC7)=O)=O)C(C)C)=O)=CS6)CC(C)C)=O)CCC5)=O)=O)N4)CC8=CC=CC=C8)C)[C@H](CC)C)C)CO
Compound: Apicidin F
SMILES: O=C1N2[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H]1CC3=CC=CC=C3)=O)CC=4C5=C(C=CC=C5)N(C4)OC)CCCCCC(=O)O)CCCC2
Compound: 13-oxoverruculogen
SMILES: O=C1N2[C@H](C(=O)N3[C@@]1(O)C(=O)C=4C5=C(C=C(OC)C=C5)N6C4[C@@H]3CC(OO[C@@H]6C=C(C)C)(C)C)CCC2
Compound: Cryptophycin-45
SMILES: ClC1=C(O)C(Cl)=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=C/C3=CC=CC=C3)C
Compound: Lydiamycin D
SMILES: O=C1N2NCCC[C@@H]2C(=O)OC[C@H](NC(=O)C3N(N=CCC3)C(=O)CC(C(=O)O)CCCC(O)C)C(N[C@@H](C(N[C@H]1C)=O)CC(C)C)=O
Compound: Preubetaomerin EG4
SMILES: O=C1C2=C(O)C=CC3=C2[C@@]4(OC=5C=CC=C6C5[C@@](O3)(CCC6=O)O4)CC1
Compound: Aquastatin A
SMILES: O=C(OC1=CC(O)=C(C(=O)O)C(=C1)C)C2=C(O)C=C(O[C@@H]3O[C@@H]([C@H](O)[C@@H]([C@H]3O)O)CO)C=C2CCCCCCCCCCCCCCC
Compound: Calbistrin E
SMILES: O=C1C=CO[C@]2([C@]1([C@@H]3C(=C[C@@H](C)C[C@@H]3OC(=O)[C@H]([C@@H](O)/C(=C/C=C/C(=C/C=C/C(=O)O)/C)/C)C)C=C2)C)C
Compound: Fuzanin B
SMILES: O=C1O[C@@H](/C=C/C=C/[C@H](O)C)[C@H]2N1C[C@H](O)C=C2C
Compound: Laetiposide D
SMILES: O=C1C(C2[C@](C3=C([C@]4([C@]([C@@H]([C@H](C(=O)O)CCC(=C)C(C)C)CC4)(C)CC3)C)[C@@H](C2)OC5OC(C(O)C(C5O)O)CO)(C)CC1)(C)C
Compound: Curtisian R
SMILES: O=C(OC1=C(O)C(=C(OC(=O)CCC2=CC=CC=C2)C(=C1C3=CC=C(O)C=C3)O)C4=CC=C(O)C=C4)CCC5=CC=CC=C5
Compound: 12-deoxo-12-hydroxy-8-O-methyltetrangomycin
SMILES: O=C1C2=C(OC)C=CC=C2C(O)C3=C1C=CC4=C3C(=O)C[C@@](O)(C)C4
Compound: Acremofuranone A
SMILES: ClC1=C(O)C2=C(O)C(=C1C)[C@@H](O)[C@H]3C(=O)C(C)(C)O[C@@H]3C(=CCCC(=CC2)C)C
Compound: Trichodermaketone B
SMILES: O=C1C2=C(O[C@@H]3[C@H]2O[C@H](CCCCCC)[C@@H]3O)[C@H](O)CC1
Compound: Pamamycin-635E
SMILES: O=C1O[C@H]([C@@H]([C@H]2O[C@@H]([C@H](C(=O)O[C@H](C[C@H]3O[C@@H]([C@@H]1CC)CC3)CCC)C)CC2)C)[C@@H]([C@@H]4O[C@H](C[C@H](N(C)C)CCC)CC4)CC
Compound: Ornibactin C4
SMILES: O=C(O)C(O)C(NC(=O)C(N)CCCN(O)C(=O)CC(O)C)C(=O)NC(C(=O)NC(C(=O)NCCCCN)CCCN(O)C=O)CO
Compound: (3aS)-6-hydroxy-3a,5,5,8-tetramethyl-3,3a,4,5-tetrahydro-1H-cyclopenta[de]isochromen-1-one
SMILES: O=C1OC[C@]2(CC(C3=C2C1=C(C=C3O)C)(C)C)C
Compound: Strobilol A
SMILES: O1[C@@]2(O)[C@](O)([C@H]3[C@H](O)[C@@]4(O[C@@H]4C[C@@H]3[C@H](C2)C)C)C(C1)=C
Compound: Tasipeptin B
SMILES: O=C1O[C@@H]([C@H](NC(=O)CCC)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=CC=C3)C)=O)CC(C)C)C2=O)O)CC(C)C)C
Compound: 5-(carboxyhydroxymethyl)uridine
SMILES: OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cc(C(O)C(O)=O)c(=O)[nH]c1=O
Compound: Antrocinnamomin F
SMILES: O=C1N(O)C(=O)C(=C1C2=CC(O)=C(C(C=C)(C)C)C=C2)CC(C)C
Compound: Spirangien Q
SMILES: O=C(O)C[C@H](OC)/C=C\C=C\C=C/C=C/C=C\[C@@H]([C@H](O)[C@@H]([C@@H](O)[C@H](CC[C@H](O)C[C@@H](OC)[C@H]([C@H](O)[C@@H]([C@@H](O)[C@@H](C/C(=C/C)/C)C)C)C)C)C)C
Compound: Erinacerin C
SMILES: O=C1NCC2=C1C=C(O)C(=C2O)C/C=C(/CC/C=C(/C(=O)O)\C)\C
Compound: 3-epifusicoccin Q
SMILES: O1[C@H](O[C@@H]2C3=C(C(C)C)C[C@@H]([C@@]3(C=C4[C@H](CO)CC[C@H]4[C@H]([C@H]2O)C)C)O)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)O
Compound: Sch 484129
SMILES: O=C(OC1C(OC(COC(=O)C)C(C1O)O)OC(CCCCCCCCCC(=O)O)CCCCCCCCC)CC(=O)O
Compound: Mycotrienin I
SMILES: O=C1NC=2C(=O)C(=CC(C2)=O)CCC=C(C(O)C(C)C(CC=CC=CC=CC(C1)OC)OC(=O)C(NC(=O)C3CCCCC3)C)C
Compound: Isoasperflavin
SMILES: O=C1C2=C(O)C3=C(OC)C=C(O)C=C3C=C2[C@@H](O)[C@@H](C1)C
Compound: Xanthepinone
SMILES: O=C1C(=COC2=C([C@@]1(O)C(=O)OC)C(=O)C=3C(O)=CC=CC3O2)C
Compound: methyl 3-(4-methoxyphenoxy)prop-2-enoate
SMILES: O=C(OC)/C=C/OC1=CC=C(OC)C=C1
Compound: Phomapyrone D
SMILES: O=C1OC(/C(=C/C(=O)C)/C)=CC(=C1C)OC
Compound: Kanchanamycin D
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=C1)C)O)O)C)O)C)O)(OC)C(O)C(C2)O)C)C)C(CCC/C=C/CCCNC(=O)N)C
Compound: (3S,6S)-dec-4-yne-3,6-diol
SMILES: O[C@H](C#C[C@@H](O)CC)CCCC
Compound: Convolvulol
SMILES: O=C1OCC=2C1=C(OC)C(=CC2CO)C
Compound: Guanacastepene L
SMILES: O=C1OC2=C3C(=O)[C@@H]4OC[C@@H]([C@@H]4[C@]3(CC[C@]5(C2=C1[C@@H](O)CC5)C)C)C
Compound: Aegyptolidine B
SMILES: Cl[C@@H]1C(=O)N[C@@H]([C@@H]1OC2=CC=C(O)C=C2)CO
Compound: Acetosellin
SMILES: O=C1C2=C(C=3C(=CC(=C4C3[C@@]1(OC4=O)C)O)/C=C/C=C/C=C/C)C[C@@H](CO)OC2
Compound: Spiroindicumide B
SMILES: O=C1C(=C(C[C@]2([C@]1(CC=C(C)C)C)OC(=O)[C@@H](C2)O)CC(=O)C)C
Compound: Bionectin B
SMILES: S1S[C@@]23N([C@H]4NC=5C=CC=CC5[C@]4([C@@H]2O)C=6C7=C(C=CC=C7)NC6)C([C@]1(N(C)C3=O)C(O)C)=O
Compound: FR-900523
SMILES: O=C1N2[C@H](C(=O)O[C@H](/C(=C/[C@H]3C[C@@H](OC)[C@H](O)CC3)/C)[C@@H]([C@@H](O)CC(=O)[C@H](C)C=C(C[C@@H](C[C@@H]([C@H]4O[C@](C1=O)(O)[C@@H](C[C@@H]4OC)C)OC)C)C)C)CCCC2
Compound: Kigamicin C
SMILES: O=C1N2C(OCC2)(CC=3C1=C(O)C=4C5=C(O)C=6C(=O)C7=C(C(O)C(OC8OC(C(OC9OC(C(O)C(C9)OC)C)CC8)C)CC7O)OC6C%10=C5C(OCO%10)CC4C3)C
Compound: Roselipin 1A
SMILES: O=C(OC[C@H](O)[C@H](O)[C@@H](O)CO)/C(=C/C(C(O)/C(=C/C(C(O)/C(=C/C(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: Epoxyquinol B
SMILES: O=C1C2=C([C@@H]3O[C@@H]([C@H]2[C@@H]4[C@H](OC=C5[C@]34C(=O)C6O[C@@H]6[C@H]5O)C)C)[C@H](O)[C@@H]7C1O7
Compound: 20-O-methyl-24-epi-cyclocitrinol
SMILES: O=C1C=C2[C@H](CC[C@]3([C@H]2CCC3[C@@](OC)(/C=C/[C@@H](O)C)C)C)C=4C[C@H]1C[C@@H](O)CC4
Compound: Acremine I
SMILES: O=C1C=C([C@@H](O)[C@@H]2[C@]1(O2)C)[C@H]3O[C@@H]3C(O)(C)C
Compound: Serratamolide
SMILES: O=C1O[C@@H](CC(=O)N[C@H](C(=O)O[C@@H](CC(N[C@H]1CO)=O)CCCCCCC)CO)CCCCCCC
Compound: Lasallic acid
SMILES: O=C(OC1=C(O)C(=C(C)C=C1O)C(=O)O)C2=C(O)C=C(OC(=O)C3=C(O)C=C(O)C=C3C)C=C2C
Compound: Yaminterritrem A
SMILES: O=C1[C@]2(CO[C@](CC1)(C)[C@@H](C2)C=3C(=O)OC(C4=CC=C(OC)C=C4)=CC3O)CCC(=O)C(C)C
Compound: S-15183b
SMILES: O=C1C=2C(=CC([C@@]1(OC(=O)CCCCCCCCC)C)=O)C=C(CCCCCCC)OC2
Compound: Loihichelin A
SMILES: O=C1N(O)CCC[C@H]1NC(=O)[C@H](NC(=O)/C(/NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)CCCCCCCCC)[C@@H](O)C(=O)O)CO)CCC(=O)N)CO)CCCN(O)C(=O)C)=C/C)CO
Compound: Ralfuranone J
SMILES: O=C1OC(O)C(=C1C(O)C2=CC=CC=C2)C3=CC=CC=C3
Compound: Hyalodendroside A
SMILES: O=C1C2=C3[C@]([C@]4([C@@H]([C@@]5([C@H](C([C@@H](O[C@@H]6O[C@@H]([C@@H](O)[C@@H]([C@H]6O)O)CO)[C@@H](C5)OC(=O)C)(C)C)CC4)CO)CC3)C)(CCC27[C@@H](OC[C@H](C7C1)C)O)C
Compound: Graphislactone E
SMILES: O=C1OC2=C(O)C(OC)=CC(=C2C=3C1=C(O)C=C(OC)C3)O
Compound: Cis-homojesterone
SMILES: O=C1C(=C([C@H](O)[C@H]2[C@@]1(O2)CC=C(C)C)CO)/C=C/C=C/C
Compound: Pyxidatol B
SMILES: O[C@@H]1[C@]2([C@H]3[C@@H](C=C([C@H]2[C@@H]1O)CO)C[C@@](C3)(CO)C)C
Compound: Farinosone C
SMILES: O=C(NC(CO)CC1=CC=C(O)C=C1)/C=C/C(=C/C(CC(=O)O)C)/C
Compound: Desferrioxamine Et1
SMILES: O=C1N(O)CCOCCNC(=O)CCC(=O)N(O)CCCCCNC(CCC(N(CCCCCNC(CC1)=O)O)=O)=O
Compound: Punctaporonin O
SMILES: O([C@H]1C=C[C@]2([C@@]1(C[C@H](O)[C@@]3([C@@H]2CC3(C)C)O)C)CO)C
Compound: Bacteriohop-6-enetetrol carbapseudopentose ether
SMILES: O(C1[C@@](O)([C@@H](O)[C@@H]([C@H]1N)O)CO)C[C@H](O)[C@H](O)[C@H](O)CCC([C@@H]2C3[C@](C4[C@@]([C@@]5(C=CC6C(CCC[C@@]6(C5CC4)C)(C)C)C)(C)CC3)(C)CC2)C
Compound: Ganodermalactone A
SMILES: O=C1O[C@H]([C@H]([C@@H]2[C@@]3([C@@](C4=C(C=C5C=CC(C([C@@H]5CC4)(C)C)=O)CC3)(C)CC2)C)C)CC=C1C
Compound: Milbemycin alpha29
SMILES: O=C1O[C@@H]2C[C@]3(O[C@@H](C2)CC=C(C[C@H](C=CC=C4[C@]5([C@H]1C=C([C@@H](O)[C@H]5OC4)COC(=O)C=6NC=CC6)O)C)C)O[C@@H]([C@@H](C)[C@@H]([C@H]3O)OC(=O)C(CC(C)C)C)C
Compound: Phyllostoxin
SMILES: O=C1C2=C(OC(=O)C)C(=CC=C2[C@@]1(C(=O)CC)C)C
Compound: Actinofuranone B
SMILES: O=C1C(=C(/C=C/CC/C(=C/C=C/[C@H]([C@@H](O)/C(=C/C)/C)C)/C)OC1(O)C)C
Compound: Cosmosporaside D
SMILES: O=C(O[C@@H]1[C@@H](O[C@H](CO)[C@H]([C@@H]1O)O)OC(C(O)(CCC=C(C)C)C)CC(OC(=O)C)C(=CCO[C@@H]([C@H](O)[C@H](O)CO)[C@H](O)CO)C)CCCCCCCCC
Compound: GGL.3
SMILES: O=C(OCC1OC(OCC(O)COC(=O)CCCCCCCCCCCC(C)C)C(O)C(C1O)OC2OC(C(O)C(C2O)O)COC(=O)C)CCCCCCCCCCCC(C)C
Compound: 15alpha-acetyl-dehydrosulphurenic acid,
SMILES: O=C(O)[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)[C@H](C1)OC(=O)C)C)CCC(=C)C(C)C
Compound: 4,6,8-trihydroxy-3-methoxy-3,7-dimethyl-4H-isochromen-1-one
SMILES: O=C1OC(OC)(C(O)C=2C1=C(O)C(=C(O)C2)C)C
Compound: Crinipellin B
SMILES: O=C1[C@]2([C@]3(C[C@@H]4C(=C)C([C@@H]5[C@@]4([C@]3([C@H]1O)C)O5)=O)CC[C@@H]2C(C)C)C
Compound: Squalestatin Y1
SMILES: O=C(O)[C@@]1(O)[C@@]2(O[C@](CCC(=C)[C@@H](OC(=O)C)[C@@H](CC3=CC=CC=C3)C)(O[C@@H]1C(=O)O)[C@@H]([C@H]2OC(=O)CCC(CC(CC)C)C)O)C(=O)O
Compound: Brocaeloid A
SMILES: O=C1C2=C(N[C@@H]([C@H]1CNC(=O)C)C(C=C)(C)C)C=CC=C2
Compound: Salinipostin H
SMILES: [P@]1(=O)(OC(=C2C(=O)OC[C@H]2CO1)CCC)OCCCCCCCCCCCCC
Compound: Astraodoric acid D
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(C([C@H](O)CC4)(C)C)CC3)C)CC2)(C)CC1)C)C)/C
Compound: Sterelactone C
SMILES: O=C1O[C@@H](O)[C@]23[C@]1(CC4=CC(C)(C)[C@@H](C4=C2C=O)OC(=O)CCCCCCC)C3
Compound: 12-Methoxyanhydrofulvic acid
SMILES: O=C1C2=C(C(OC)=C(O)C=C2OC3=C1COC(=C3)C)C(=O)O
Compound: Pitholide C
SMILES: O=C1O[C@@]2([C@H](O)C3=COC(=CC3=CC2=C1C(=O)CCCCC[C@H](O)C)C)C
Compound: Butyrolactol B
SMILES: O=C1OC(C(O)C(O)C(O)C(O)C(O)C(C/C=C/C=C/CC/C=C\C=C\CCC(C)C)C)C(C1O)O
Compound: Mupirocin F
SMILES: O=C1[C@@H](O)[C@@H](OC[C@@H]1C[C@@H]2O[C@H]2[C@H]([C@@H](O)C)C)C/C(=C/C(=O)OCCCCCCCCC(=O)O)/C
Compound: Daidzein 7-alpha-L-rhamnoside
SMILES: O=C1C(C2=CC=C(O)C=C2)=COC3=C1C=CC(=C3)O[C@@H]4O[C@H]([C@H](O)[C@H]([C@H]4O)O)C
Compound: Phthoxazolin A
SMILES: O=C(N)C([C@H](O)\C(=C/C=C\C=C\CC=1OC=NC1)\C)(C)C
Compound: 1,10-seco-2,3-seco-aromadendrane
SMILES: O=C(CC[C@@H]1[C@](CO)(C)[C@@H]1[C@H]2[C@H](COC(C2)O)C)C
Compound: Sulphostin
SMILES: S(=O)(=O)(O)N[P@](=O)(N1C(=O)[C@@H](N)CCC1)N
Compound: Dehydrotrametenonic acid
SMILES: O=C1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H](C(C(=O)O)CCC=C(C)C)CC4)(C)CC3)C)=CC2)(C)CC1)(C)C
Compound: Shurimycin A
SMILES: O=C1OC(C(C=CC=C(C(O)C(C(O)CC(O)CC(OC(=O)CC(=O)O)CC2OC(CC(C(CCC(C(C(CC(C(C=CC=C1)C)O)O)C)O)C)O)(O)C(O)C(C2)O)C)C)C)C(CCC/C=C/CCCNC(=NC)N)C
Compound: Epi-aszonalenin A
SMILES: O=C1N2[C@H]3N(C=4C=CC=CC4[C@@]3(C(C=C)(C)C)C[C@H]2C(=O)NC5=C1C=CC=C5)C(=O)C
Compound: Penochalasin C
SMILES: O=C1C(=C[C@H](CC=C[C@@H]2[C@]3(C=4NC1=CC4)C(=O)N[C@H]([C@@H]3[C@H](C)C([C@H]2O)=C)CC=5C6=C(C=CC=C6)NC5)C)C
Compound: Mycobactin J
SMILES: O=C1N(O)CCCC[C@@H]1NC(=O)[C@H]([C@H](OC(=O)[C@@H](NC(=O)[C@H]2N=C(C3=CC=CC=C3)O[C@@H]2C)CCCCN(O)C(=O)/C=C\CCCCCCCCCCCCC)CC)C
Compound: CJ-12,373
SMILES: O=C(O)C1=C(O)C2=C(C[C@H](CCCCCCC)O[C@@H]2O)C=C1O
Compound: 7,10-dihydroxydehydrodihydrobotrydial
SMILES: O1[C@H](O)C2=C(C=CC3=C2[C@@](C1)([C@H](O)C3(C)C)C)C
Compound: Cohaerin C
SMILES: O=C1C=C2C(=COC(=C2)C=3C(=O)CC(O)CC3C)[C@@H]4[C@]1(OC(=O)[C@@H]4C(=O)C(CCCCCC)C)C
Compound: Atroviridin B
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CO)CC2=CC=CC=C2)CCC(=O)N)CCC(=O)N)(CC)C)(C)C)C(C)C)CCC1)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C3N(C(=O)C(NC(=O)C)(C)C)CCC3)(C)C)C)(C)C)C)CCC(=O)N)(C)C)C(C)C)(C)C)CC(C)C)(C)C
Compound: Lyngbouilloside
SMILES: O=C1OC(C[C@H](O)[C@@H](CC[C@@H]2O[C@@](C1)(O)C[C@H](OC3O[C@H]([C@H](OC)[C@H]([C@H]3OC)O)C)C2)C)(CC/C=C/C=C/CC)C
Compound: 2-(D-glycerol-1,2-dihydroxyethyl)furan
SMILES: O1C(=CC=C1)[C@H](O)CO
Compound: Pretrichodermamide A
SMILES: S1SC(C2=C(O)C(OC)=C(OC)C=C2)[C@@H]3C(N4[C@]1(C(=O)N3)C[C@]5(O)[C@H](O)C=C[C@H]([C@@H]5O4)O)=O
Compound: 2096A/B
SMILES: O=C1N(C(=O)C2(NC(=O)N(N=C2N1C)C)C3N=C(N)NC3=O)C
Compound: Ramarin A
SMILES: O=C1C=C2[C@]([C@H](CC[C@@H]2O)C)(C)[C@@H]3[C@H]1[C@]3(CO)C
Compound: Mannopeptimycin alpha
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]5O)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: Communesin B
SMILES: O=C(N1[C@@H]2N3[C@@H](C=4C=CC=C5C4[C@@]6([C@]2(C7=C(N[C@@H]6N5C)C=CC=C7)CC1)CC3)C8OC8(C)C)/C=C/C=C/C
Compound: Neoatroviridin D
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)(CC)C)CC(C)C)(C)C)(CC)C)(C)C
Compound: Cercophorin A
SMILES: O=C1OC(=CC=2C1=C(O)C(=C(O)C2)C(=O)C3=C(O)C=C(OC)C=C3C(=O)OC)C
Compound: Asperaculane A
SMILES: O=C(O)/C(=C\1/[C@@H]2[C@@]([C@@H](O)CC(=CC2)CO)(C)CC1)/C
Compound: (-)-petchioic A
SMILES: O=C(O)[C@]1(C=C(CCC1)CC)CC(=O)OC
Compound: 2-deoxy-20-hydroxy-5alpha-ecdysone 3-acetate
SMILES: [H][C@]12CC[C@]3(C)[C@]([H])(CC[C@@]3(O)C1=CC(=O)[C@@]1([H])C[C@H](CC[C@]21C)OC(C)=O)[C@@](C)(O)[C@H](O)CCC(C)(C)O
Compound: Alternaroside C
SMILES: O=C(N[C@H]([C@H](O)/C=C/CC/C=C\CCCCCCCCC)CO[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@H]1O)O)CO)[C@H](O)/C=C/CCCCCCCCCCCCCC
Compound: 4-Desmethyl-9-keto-epothilone C
SMILES: S1C(=NC(=C1)/C=C(/C2OC(=O)C[C@H](O)C(C(=O)[C@@H]([C@@H](O)[C@H](C(CCC=CC2)=O)C)C)C)\C)C
Compound: 24-ethylcholesta-7,22E-diene-3beta,5alpha,6beta-triol
SMILES: O[C@]12[C@@]([C@@H]3C([C@H]4[C@]([C@@H](C(/C=C/C(C(C)C)CC)C)CC4)(C)CC3)=C[C@H]1O)(CC[C@@H](C2)O)C
Compound: 4,25-dehydro-22-deoxyminiolutelide B
SMILES: O=C1OC(C2=C[C@@H]3O[C@@]4(O)[C@H](O[C@@H]5[C@@H]6[C@]4([C@]3([C@@H](C(C2=C1)=C)C[C@@]6(C(=O)O5)C)C)C(=O)OC)C)(C)C
Compound: Rutilin B
SMILES: O=C1/C(/C2=C(COC(=C2)/C=C/COC(=O)C)C(C1(OC(=O)C3=C(O)C=C(O)C=C3C)C)=O)=C\C=C\C=4OCC=5C(=O)[C@@](OC(=O)C6=C(O)C=C(O)C=C6C)(C)[C@@H](CC5C4)O
Compound: Stagonolide B
SMILES: O=C1O[C@@H]([C@@H](O)[C@@H](O)C=C[C@@H](CC1)O)CCC
Compound: Mycinamicin XVII
SMILES: O=C1O[C@@H](C(C=CC=CC(=O)[C@@H](C[C@H]([C@@H]([C@H](C=C1)C)O[C@@H]2O[C@@H](CC(C2O)N(C)C)C)C)C)CO[C@@H]3OC([C@H](O)[C@@H]([C@@H]3OC)OC)C)CC
Compound: N-(2-methyl-3-oxodecanoyl)pyrrolidine
SMILES: O=C(N1CCCC1)[C@H](C(=O)CCCCCCC)C
Compound: Novae-zelandin B
SMILES: O=C1OC(=C(C/C=C/C(=O)O)C(=C1)OC)C
Compound: Mutadione B
SMILES: O=C1OC=2C=C(O)C(=C(C2[C@]13C(=O)C(O)=C(C3=O)CCCCCCC/C=C\CCCCCCCC)CCCCCCC/C=C\C/C=C\CCCCC)O
Compound: Karnamicin C1
SMILES: S1C(=NC(=C1)C2=NC(=C(O)C(=C2OC)OC)C(=O)N)CC[C@@H](O)CC
Compound: Beta-D-Galactosylvalidoxylamine A
SMILES: O1C(OC2C(O)C(O)C(NC3C=C(C(O)C(C3O)O)CO)CC2CO)C(O)C(O)C(C1CO)O
Compound: Pyrenochaetoxy A
SMILES: O1[C@H](C2=C(OC)C=CC=C2OC)C=3C(OC)=C(CO)C=C(C3C1)O
Compound: Trichovirin II 3a
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)(C)C)CCC(=O)N)(CC)C)C(C)C)(C)C)(C)C)(C)C
Compound: Mniopetal A
SMILES: O=C1O[C@H](O)[C@@H]2[C@]13[C@@H](O)[C@@H](OC(=O)[C@H](OC(=O)C)CCCCCCCC)CC([C@@H]3CC=C2C=O)(C)C
Compound: Aspernidine B
SMILES: O=C1NCC2=C1C=C(O)C(=C2O)OC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C
Compound: Tramspiroin B
SMILES: O=C1O[C@@H]2[C@@]3(C=C(C)[C@H](C3)O)[C@@H](C)CC[C@@H]2[C@@H]1C
Compound: (2'E)-Roridin L-2
SMILES: O=C1OCC(=C1)CCO[C@H](/C=C/C=C/C(=O)O[C@H]2[C@@]3([C@@]4([C@@H](C=C(C)CC4)O[C@H](C2)[C@]35OC5)CO)C)[C@H](O)C
Compound: Berkeleyacetal B
SMILES: O=C1OC(C2=CC[C@]3([C@H]([C@]4(C2=C1)OC4)C[C@]5(C(=O)O[C@@H]6[C@H]5[C@]3(C(=O)[C@@H](O6)C)C(=O)OC)C)C)(C)C
Compound: Banyasin A
SMILES: O=C1N(C(C(=O)N[C@H](C(=O)N[C@@H](C)C(NC(C(C(N[C@H]1CCCN=C(NC(=O)NC)N)=O)C)C/C=C/CC)=O)CC(=O)O)CC2=CC=CC=C2)C
Compound: 2-hydroxy-2,4-dimethyl-3(2H)-benzofuranone
SMILES: O=C1C2=C(C=CC=C2O[C@@]1(O)C)C
Compound: Evariquinone
SMILES: O=C1C2=C(O)C(O)=C(O)C=C2C(=O)C=3C1=C(OC)C=C(C)C3
Compound: Daedaleaside C
SMILES: O=C1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@H](C(=O)OC5O[C@@H]([C@@H](O)[C@@H]([C@H]5O)O)COC(=O)C)CCC(=C)C(C)C)[C@@H](C4)OC(=O)C)(C)CC3)C)=CC2)(C)CC1)(C)C
Compound: Penilumamide D
SMILES: O=C1N(C(=O)C=2N=C(C(=O)N[C@H](C(=O)NC3=C(C(=O)N)C=CC=C3)C)C=NC2N1C)C
Compound: (1R,3S,9S,24R,32R)-32-hydroxy-15,19-dimethoxy-28-methyl-6,10,17-trioxa-25,26-dithia-2,28-diazaheptacyclo[22.2.2.11,4.12,24.112,16.118,22.03,9]dotriaconta-4,7,12(31),13,15,18,20,22(30)-octaene-11,27,29-trione
SMILES: S1S[C@@]23N4[C@@H]5[C@@H](OC(=O)C=6C=CC(=C(OC=7C=C(C[C@]1(N(C)C2=O)C4=O)C=CC7OC)C6)OC)C=COC=C5[C@H]3O
Compound: Communiol D
SMILES: O1[C@@H]2O[C@@H](CCO)C[C@@H]2C[C@H]1[C@@H](O)CC
Compound: Gymnastatin H
SMILES: O=C(N[C@H](C(=O)OC)CC1=CC=C(O)C=C1)/C=C/C(=C/[C@@H](CCCCCC)C)/C
Compound: Norbisebromoamide
SMILES: BrC1=C(O)C=CC(=C1)C[C@@H](N(C(=O)[C@@H](NC(=O)C(C)(C)C)C)C)C(=O)N2[C@H](C=3SC[C@H](N3)C(=O)N[C@@H](C(=O)N([C@H](C(=O)N4[C@H](C(=O)CC)CCC4)CC5=CC=CC=C5)C)CC(C)C)C[C@@H](C2)C
Compound: Brabetaicicene D
SMILES: O=C1C(=C)[C@]2(O)C=C3[C@](O)(CC[C@H]3[C@H]([C@H](CC2=C1C(C)C)O)C)COC
Compound: Sclerocitrin
SMILES: O=C1O/C(=C(\C2=CC=C(O)C=C2)/C(=O)O)/C(=C1C3=CC(=O)[C@@]4([C@H]3[C@H]5C(=O)O[C@@H]6[C@@]5(C=7C(=O)O\C(\C7O)=C(/C8=CC=C(O)C=C8)\C(=O)O)[C@H]4C(=O)C6)O)O
Compound: Saccharosacrin E
SMILES: O=C1OC23C(C=C(C(OC4OC(C(NC(=O)C)C(C4)(O)C)C)C(C)C=C(C5C(C(=C1C2=O)O)(C6C(C(OC7OC(C(OC8OC(C(OC9OC(C(O)C(C9)O)C)C(C8)O)C)CC7)C)C(C)CC6C)C=C5)C)C)C)C=CC(C3)CCC
Compound: Chromophenazine E
SMILES: O=C(O)C1=C2NC3=C(C=C(C(=O)C4=CC=CC=C4)C=C3)N(C2=CC(=C1)C(=O)C5=CC=CC=C5)CC=C(C)C
Compound: Marasmene B
SMILES: O1[C@H](O)[C@@]23[C@H](C(CCC2)(C)C)CC=C4[C@@H]3[C@@H]1OC4
Compound: 6-O-acetyl hygrophorone A14
SMILES: O=C1C=C[C@@H]([C@]1(O)C(OC(=O)C)CCCCCCCCCCCCCC)O
Compound: Cristatumin C
SMILES: O=C1N2[C@@H]3NC=4C=CC=CC4[C@]3(C56C7=C(C=CC=C7)N[C@@H]5N8C(=O)[C@H](C)NC([C@@H]8C6)=O)C[C@@H]2C(=O)N[C@@H]1C(C)C
Compound: Asterriquinone SU-5501
SMILES: O=C1C(O)=C(C(=O)C(=C1C=2C3=C(C=CC=C3)N(C2)C(C=C)(C)C)O)C=4C5=C(C(=CC=C5)CC=C(C)C)NC4
Compound: Truncaquinone A
SMILES: O=C1C(OC)=C(C(=O)C(=C1C=2C3=C(C=CC=C3)NC2C(C=C)(C)C)O)C=4C5=C(C=CC=C5)NC4
Compound: 23-(9-methyl)decanoic acid demalonylazalomycin F4a ester
SMILES: O=C1O[C@H](C(C=CC=C([C@@H](O)C[C@H](O)C[C@@H](O)C[C@H](OC(=O)CCCCCCCC(C)C)C[C@@H]2O[C@@](C[C@@H]([C@H](CCC(C(C(CC(C(C=CC=C1C)C)O)O)C)O)C)O)(O)[C@@H](O)[C@@H](C2)O)C)C)[C@H](CCCC=CCCCNC(=NC)N)C