MonarchInit/C3PO huggingface dataset:
Compound: Palmarumycin C11
SMILES: O1C=2C3=C(C=CC=C3C=CC2)OC14C5=C(C(O)=CC=C5)[C@@H](O)[C@H]6[C@@H]4O6
Compound: Cyclo(S-Phe-S-Gln)
SMILES: O=C1N[C@H](C(=O)N[C@H]1CC2=CC=CC=C2)CCC(=O)N
Compound: Mabetaetolide C
SMILES: O=C1OC([C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)C[C@@H](O)CCCCCCCCC)CC(C)C)CCC(=O)O)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(CC)C)=O)CO)=O)CC(C)C)=O)CO)CC(C)C)C(CC)C)C
Compound: Marinobactin F
SMILES: O=C1NCC[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCN(O)C(=O)C)CO)CCCN(O)C(=O)C)CO)NC([C@@H]([C@H]1O)NC(=O)CCCCCCCCCCCCCCCCC)=O
Compound: Flammuspirone C
SMILES: O=C1C(=C[C@@]2(C1)[C@H](O)[C@H](C(O)(C)C)CC[C@H]2C)C
Compound: Colletochlorin A
SMILES: ClC1=C(O)C(=C(O)C(=C1C)C=O)C/C=C(/CC[C@@H](O)C(O)(C)C)\C
Compound: Stealthin A
SMILES: OC=1C2=C(O)C=CC=C2C(O)=C3C1C(=N)C=4C=C(CO)C=C(C34)O
Compound: Alpha-acorenol
SMILES: OC(C1[C@@]2([C@@H](C)CC1)CC=C(C)CC2)(C)C
Compound: Tolypocladenol A2
SMILES: O=C1N/C(=C\C2=CC=C(O)C=C2)/C(=C1C(=O)[C@H](C[C@H](C/C=C\C)C)C)O
Compound: Xanthorin 1-O-methyl ether 8-O-beta-D-ge
SMILES: O=C1C2=C(C(=O)C=3C1=C(OC)C=C(CO)C3)C(O)=C(OC)C=C2OC4OC(C(O)C(C4O)O)COC5OC(C(O)C(C5O)O)CO
Compound: Flammuspirone D
SMILES: O=C1C(=C[C@@]2(C1)[C@H](O)[C@H](C(O)(C)C)CC[C@H]2CO)C
Compound: Protocatechuic alcohol
SMILES: OC1=C(O)C=CC(=C1)CO
Compound: Kobifuranone B
SMILES: O=C1OCC(=C1/C=C/C=C/C)[C@@H](O)C
Compound: Ishigamide
SMILES: O=C(NCCC(=O)O)/C=C/C=C/C=C/C=C/CCC[C@@H](O)C
Compound: Tolypocladenol A1
SMILES: O=C1N/C(=C\C2=CC=C(O)C=C2)/C(=C1C(=O)[C@@H](C[C@@H](C/C=C\C)C)C)O
Compound: Pochonin I
SMILES: ClC1=C(O)C=C(O)C2=C1CC(=O)C3=C(C=CC=C3)C[C@H](OC2=O)C
Compound: Flammuspirone E
SMILES: O=C1C(=C[C@@]2(C1)[C@H](O)[C@H](C(O)(C)C)CC[C@H]2C)CO
Compound: Spencertoxin
SMILES: OCC(C1=CN=CC=C1)C(C2=CN=CC=C2)CO
Compound: Thyrsiferyl-23-acetate
SMILES: Br[C@@H]1C(O[C@]([C@H]2O[C@@H]3[C@@](OC(C(O)(CC[C@@H](O)[C@@]4(O[C@@H](C(OC(=O)C)(C)C)CC4)C)C)CC3)(C)CC2)(C)CC1)(C)C
Compound: Cyclophellitol
SMILES: O1[C@H]2[C@H](O)[C@@H](O)[C@@H]([C@H]([C@@H]12)CO)O
Compound: Venemycin
SMILES: O=C1OC(C2=CC(O)=CC(=C2)O)=CC(=C1)O
Compound: Flammuspirone F
SMILES: O=C1C(=C[C@@]2(C1)[C@H](O)[C@H](C(O)(CO)C)CC[C@H]2C)C
Compound: N-[(E)-2-(4-hydroxyphenyl)ethenyl]hexadecanamide
SMILES: O=C(N/C=C/C1=CC=C(O)C=C1)CCCCCCCCCCCCCCC
Compound: Spencer acid
SMILES: O=C(O/C=C\C(=O)O)O/C=C\C(=O)O
Compound: 3-epi-illudol
SMILES: O[C@@H]1C(=C2[C@@]([C@H](O)C2)(C)[C@@H]3[C@H]1CC(C)(C)C3)CO
Compound: methyl antcinate G
SMILES: O=C1C2=C([C@H](OC(=O)C)CC3C2(CCC([C@H]3C)=O)C)[C@@H]4CCC(C4(C1)C)C(CCC(=C)C(C(=O)OC)C)C
Compound: Carneamide A
SMILES: O=C1N[C@](C(=O)N2C1=CCC2)(CC=3C4=C(C=C5OC(C)(C)C=CC5=C4)NC3C(C=C)(C)C)C
Compound: Sphaericin
SMILES: O=C1N2C(C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](CC=3C4=C(C=CC=C4)NC3)C(N[C@H](C(N[C@H](CCC(NCC(N[C@H]1CC(C)C)=O)=O)C(=O)N[C@H](C(=O)N5C(C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N6C(C(=O)N[C@H](C(=O)O)[C@@H](CC)C)CCC6)CC7=CC=CC=C7)CC8=CC=C(O)C=C8)CC=9C%10=C(C=CC=C%10)NC9)CO)CCC5)CCCNC(=N)N)=O)[C@@H](CC)C)=O)CC=%11C%12=C(C=CC=C%12)NC%11)[C@@H](CC)C)CCC2
Compound: Flammuspirone G
SMILES: O=C1C(=C[C@@]2(C1)[C@H](O)[C@H](C(C)C)C[C@@H]([C@H]2C)O)C
Compound: Penicillenol D1
SMILES: O=C1N(/C(=C\C)/C(=C1C(=O)[C@H](CCC/C=C/C)C)O)C
Compound: Sesquicillin D
SMILES: O=C1OC(=C(C)C(=C1C[C@@H]2C(=C)CC[C@@H]3[C@@]2(CC[C@@H]([C@]3(CCC(O)C(=C)C)C)OC(=O)C)C)O)C
Compound: Neovasipyridone F
SMILES: O=C1C(C(=O)CC)=CN(CCCC(=O)N)C(C1(O)C)/C(=C\C(CC)C)/C
Compound: Cyclosporin C
SMILES: O=C1N([C@H](C(=O)N[C@H](C(=O)N(CC(=O)N([C@H](C(=O)N[C@H](C(=O)N(C)[C@H](C(N[C@H](C(N[C@@H](C(N([C@H](C(N([C@H](C(N([C@H]1C(C)C)C)=O)CC(C)C)C)=O)CC(C)C)C)=O)C)=O)C)=O)CC(C)C)C(C)C)CC(C)C)C)C)[C@H](O)C)[C@H](O)[C@@H](C/C=C/C)C)C
Compound: 7,13,14-trihydroxy-4-cadinen-15-oic acid methyl ester
SMILES: O=C(OC)C1=CC2C([C@@](O)(CC[C@H]2[C@@H](CO)C)CO)CC1
Compound: Elansolid B2
SMILES: O=C(O)C=CC(=CC[C@H](O)[C@H]([C@@H](O)C=CC=CC=C[C@H]1C(=C[C@H]2[C@@](O)(C)CC([C@@H]2[C@H]1[C@H](OC)C3=CC=C(O)C=C3)(C)C)C)C)C
Compound: 2-methyl-fervenulone
SMILES: O=C1N=C2N(C(=O)N(C2=NN1C)C)C
Compound: 2,4,5-Trichloro-lichexanthone
SMILES: ClC1=C2OC3=C(Cl)C(OC)=CC(=C3C(C2=C(O)C(=C1OC)Cl)=O)C
Compound: Ripostatin C
SMILES: O=C(O)/C=C(/CC(=O)O)\C/C=C/C/C=C(/C[C@@H](O)C/C=C/C(=O)CC/C(=C/CC1=CC=CC=C1)/C)\C
Compound: Dietziamide B
SMILES: O=C1N/C(=C\C)/C(=C1C(C=2C(=O)N\C(\C2O)=C/C)[C@@H](O)CO)O
Compound: 3,9,25-Trihydroxy-24-hydroxymethylergosta-7,22-dien-6-one
SMILES: O=C1C=C2[C@](O)(CC[C@]3([C@H]2CC[C@@H]3[C@@H](/C=C/[C@@H](C(O)(C)C)CO)C)C)[C@@]4([C@@H]1C[C@@H](O)CC4)C
Compound: Intervenolin
SMILES: S(C(SC)=NCN1C2=C(C(=O)C(=C1CC=C(CCC=C(C)C)C)C)C=CC=C2)C
Compound: Elansolid B3
SMILES: O=C(O)C=CC(=CC[C@H](O)[C@H]([C@@H](O)C=CC=CC=C[C@H]1C(=C[C@H]2[C@@](O)(C)CC([C@@H]2[C@H]1[C@H](N)C3=CC=C(O)C=C3)(C)C)C)C)C
Compound: Cis-7-chloro-4-hydroxymellein
SMILES: ClC1=C(O)C=2C(=O)O[C@H](C)[C@@H](C2C=C1)O
Compound: Ochrobactin A
SMILES: O=C(N(O)CCCCC(NC(=O)CC(O)(C(=O)O)CC(=O)NC(C(=O)O)CCCCN(O)C(=O)/C=C/CCCCC)C(=O)O)/C=C/CCCCCCC
Compound: 3,14,25-Trihydroxy-24-hydroxymethylergosta-7,22-dien-6-one
SMILES: O=C1C=C2[C@@]3(O)[C@@]([C@@H]([C@@H](/C=C/[C@@H](C(O)(C)C)CO)C)CC3)(CC[C@@H]2[C@@]4([C@@H]1C[C@@H](O)CC4)C)C
Compound: 8-(4'-O-methyl-alpha-rhamnopyranosyloxy)-3,4-dihydroquinolin-2(1H)-one
SMILES: O=C1NC2=C(OC3OC(C(OC)C(C3O)O)C)C=CC=C2CC1
Compound: Austroviridin A
SMILES: O=C1C2=C(O)C[C@@](O)(C)CC2=C3C4=C5C(=O)C6=C(C(OC)=CC(=C6)C)C(=C5C(=O)C=C4OC=7C3=C1C(OC)=CC7OC)O
Compound: 8-(4'-O-methyl-alpha-ribopyranosyloxy)-3,4-dihydroquinolin-2(1H)-one
SMILES: O=C1NC2=C(OC3OCC(OC)C(C3O)O)C=CC=C2CC1
Compound: Plusbacin B3
SMILES: O=C1OC(CC(=O)N[C@@H](C(=O)N[C@@H](C(=O)N2[C@H](C(=O)N[C@H](C(N[C@@H](C(N[C@@H](C(N3[C@H](C(N[C@H]1[C@H](O)C(=O)O)=O)[C@H](O)CC3)=O)CO)=O)[C@@H](O)C(=O)O)=O)CCCN=C(N)N)CCC2)C)[C@H](O)C)CCCCCCCCCCC(C)C
Compound: Ochrobactin B
SMILES: O=C(N(O)CCCC[C@H](NC(=O)CC(O)(C(=O)O)CC(=O)N[C@H](C(=O)O)CCCCN(O)C(=O)CCCCCCC)C(=O)O)/C=C/CCCCCCC
Compound: Spiroaspertrione A
SMILES: O=C1C=C([C@]23COC(C3=C[C@@]1(C[C@]42C(=O)[C@]5(C=CC(=O)C([C@@H]5CC4)(C)C)C)C)=O)C
Compound: Factor Fo
SMILES: O=C1NC=2N(C=3C(C=CC(C3)=O)=CC2C(N1)=O)CC(O)C(O)C(O)CO
Compound: Pyrenochaetamide A
SMILES: O=CN/C=C/C1=CC(=C(O)C=C1)C2=C(O)C=CC(=C2)/C=C/NC=O
Compound: Plusbacin B4
SMILES: O=C1OC(CC(=O)N[C@@H](C(=O)N[C@@H](C(=O)N2[C@H](C(=O)N[C@H](C(N[C@@H](C(N[C@@H](C(N3[C@H](C(N[C@H]1[C@H](O)C(=O)O)=O)[C@H](O)CC3)=O)CO)=O)[C@@H](O)C(=O)O)=O)CCCN=C(N)N)CCC2)C)[C@H](O)C)CCCCCCCCCCCCC
Compound: Chandrananimycin B
SMILES: O=C1C(NC(=O)CO)=CC2=NC=3C=CC=CC3OC2=C1
Compound: Ochrobactin C
SMILES: O=C(N(O)CCCC[C@H](NC(=O)CC(O)(C(=O)O)CC(=O)N[C@H](C(=O)O)CCCCN(O)C(=O)/C=C/CCCCCCC)C(=O)O)/C=C/CCCCCCC
Compound: Andiconin B
SMILES: O=C1C=C[C@@]2([C@H]3[C@]4([C@@]56[C@@H](C(=O)OC5)[C@@H](O)[C@@](C4)(C)C([C@@]6(C3)C)=O)CC[C@H]2C1(C)C)C
Compound: Funiculosin
SMILES: O=C1N(C=C(C2C(O)C(O)C(C2O)O)C(=C1C3OC(C(C)=CC3)/C(=C/C(CC(CC)C)C)/C)O)C
Compound: Oasomycin A
SMILES: O=C1OC(C(C2OC(=O)CC2)C)CC=CC(O)CC(O)CC(O)C(C(O)C(C(O)CC(O)CC(O)CC(O)C(O)C=C(C(C(C=CC(C(C=CCCC(C(C(C(CCC=C1C)C)O)C)O)C)O)C)O)C)C)C
Compound: Guangnanmycin A
SMILES: S1C2=NC(=C1)C=C(C=CC(=C)[C@H](O)C=C(CC[C@@](CC(NC23CC3)=O)(S)CC(=O)O)C)C
Compound: Cyclohelminthol X
SMILES: ClC1=C(C(=O)[C@@]2(C1=O)[C@]3(C(=O)NC([C@@]23CCCCCC)=O)C(=O)[C@@H]4[C@@](O)(C(=O)/C=C/C)C[C@H]5[C@H]4[C@H](C[C@@H](C(=O)O)C5)C)/C=C/C
Compound: Chojalactone B
SMILES: O=C1OC[C@H]([C@@]1(O)C(=O)C=CC=CC=CC)C
Compound: Chandrananimycin A
SMILES: O=C1C(NC(=O)C)=CC2=NC=3C(O)=CC=CC3OC2=C1
Compound: Welwitindolinone B isothiocyanate
SMILES: Cl[C@H]1[C@@](C=C)([C@@]2(N=C=S)C3=C4C(NC([C@@H]4C([C@@H](C1)C2=O)(C)C)=O)=CC=C3)C
Compound: 3-(methylthio)phomamide
SMILES: S([C@]1(NC(=O)[C@H](CO)NC1=O)CC2=CC=C(OCC=C(C)C)C=C2)C
Compound: Grecoketide B
SMILES: O=C1C(=O)C(=C(O)C2=C1C=CC(=C2O)C3O[C@@H](C(OC4OC(C(O)CC4)C)CC3)C)CC(=O)O
Compound: Weishanmycin A1
SMILES: S1[C@@]2(CC(=O)N[C@@H](C=3SC=C(N3)C=C(C=CC(C[C@@H]1[C@](O)(C)CC2)=C)CCC)C)CC(=O)O
Compound: Svetamycin A
SMILES: Cl[C@@H]1CNN2C(=O)[C@@H](NC(=O)[C@H]3N(N=C[C@H]([C@H]3O)O)C(=O)COC([C@@](NC([C@H]4N(C([C@H]2C1)=O)NCCC4)=O)(CO)C)=O)C
Compound: Verrucigeric acid
SMILES: O=C1OC2=C3C4=C(C(=O)OC4OC(OCC=5C(=C1C(=CC5OC)C)O3)(O)C)C(=C2C)O
Compound: Hygrocin B
SMILES: O=C1O[C@H]([C@@H](O)C=CC(CCC(C=2C=3C(C=4[C@@]1(C=CC(=O)NC4C(=O)C3C=C(C)C2O)C)=O)=O)CC)C
Compound: 5-hydroxymethylfuran-3-carboxylic acid
SMILES: O=C(O)C1=COC(=C1)CO
Compound: AK-toxin II
SMILES: O=C(O)/C=C/C=C/C=C/C(OC(=O)C(NC(=O)C)CC1=CC=CC=C1)C2(OC2)C
Compound: Svetamycin B
SMILES: Cl[C@@H]1CNN2C(=O)[C@@H](NC(=O)[C@H]3N(N=C[C@H]([C@H]3O)O)C(=O)COC([C@@](NC([C@H]4N(C([C@H]2C1)=O)NC(CC4)C)=O)(CO)C)=O)C
Compound: Cylindrocyclophane F
SMILES: OC1=C2C(O)=CC(=C1)C[C@H](CCCC[C@@H](C3=C(C=C(C[C@H](CCCC[C@@H]2CCCC)C)C=C3O)O)CCCC)C
Compound: (3R,5R)-3,5-dihydroxydecanoic acid
SMILES: O=C(O)C[C@H](O)C[C@H](O)CCCCC
Compound: F-11334-A2
SMILES: O1C2=C(C=C(O)C=C2)C[C@H]1C(O)(C)C
Compound: Cladoquinazoline
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@H](NC([C@H]2C[C@]4(O)C(=O)NC5=C4C=CC=C5)=O)C(C)C
Compound: Pre-aurantiamine
SMILES: O=C/1N[C@H](C(=O)N\C1=C/C=2NC=NC2)C(C)C
Compound: Cylindrocyclophane B
SMILES: O=C(O[C@H]1C2=CC(O)=C([C@H](CCCC[C@@H]([C@@H](O)C3=CC(=C([C@H](CCCC[C@@H]1C)CCCC)C(O)=C3)O)C)CCCC)C(=C2)O)C
Compound: Svetamycin C
SMILES: Cl[C@@H]1CNN2C(=O)[C@@H](NC(=O)[C@H]3N(N=C[C@H]([C@H]3O)O)C(=O)COC([C@@](NC([C@H]4N(C([C@H]2C1)=O)NC(CC4)(C)C)=O)(CO)C)=O)C
Compound: Purpactin B
SMILES: O=C1C=C(C=C(C12OC=3C=CC(=C(C3C2=O)OC)C(OC(=O)C)CC(C)C)CO)C
Compound: Picronolide
SMILES: O=C1OC(C(O)(C=CC(=O)C(C)CC(C(C(C(C1C)=O)C)O)C)C)CC
Compound: (-)-Caprazamycin C
SMILES: O=C1N([C@H](C(=O)O)[C@@H](OC(=O)C[C@@H](OC(=O)C[C@@H](CC(=O)O[C@@H]2O[C@H](C(OC)[C@H]([C@H]2OC)OC)C)C)CCCCCCCCCCCC)CN([C@H]1[C@H](O[C@@H]3O[C@H](CN)[C@H]([C@H]3O)O)[C@H]4O[C@@H](N5C(=O)NC(=O)C=C5)[C@@H]([C@@H]4O)O)C)C
Compound: Arbumelin
SMILES: O=C1N[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(NCC(NCC(N[C@H](C(N[C@@H]1C(C)C)=O)CO)=O)=O)=O)C(C)C)CC(C)C)CC2=CC=C(O)C=C2)CC3=CC=C(OC)C=C3
Compound: Svetamycin D
SMILES: Cl[C@@H]1CNN2C(=O)[C@@H](NC(=O)[C@H]3N(N=C[C@H]([C@H]3O)O)C(=O)COC([C@@](NC([C@H]4N(C([C@H]2C1)=O)N=CCC4)=O)(CO)C)=O)C
Compound: Cylindrocyclophane C
SMILES: OC1=C2C(O)=CC(=C1)[C@H](O)[C@H](CCCC[C@@H](C3=C(C=C(C[C@H](CCCC[C@@H]2CCCC)C)C=C3O)O)CCCC)C
Compound: Bu-2470 B2a
SMILES: O=C1NC(C(=O)NC(C(=O)NC(C(=O)NC(CCN)C(NC(C(NC(C(NCCC1NC(=O)C(NC(=O)CC(O)CCCCC(C)C)CCN)=O)CC(C)C)=O)CCN)=O)CC(C)C)CC2=CC=CC=C2)CCN
Compound: Cristatumin A
SMILES: O=C/1N[C@H](C(=O)N\C1=C/C=2C3=C(C=CC=C3)NC2C(C=C)(C)C)CO
Compound: Merochlorin B
SMILES: ClC=1C(=O)C2=C(O)C=C(O)C=C2[C@@]34C1O[C@](CCC=C(C)C)(C)[C@@H]3CC(C4)=C(C)C
Compound: Arbumycin
SMILES: O=C1O[C@H](C(=O)N[C@H](C(=O)O[C@H](C(N[C@H](C(N[C@H]1[C@H](O)C)=O)C)=O)[C@@H](CC)C)[C@H](CC)C)[C@@H](CC)C
Compound: Cylindrocyclophane D
SMILES: O=C(O[C@H]1C2=CC(O)=C([C@H](CCCC[C@@H]([C@@H](OC(=O)C)C3=CC(=C([C@H](CCCC[C@@H]1C)CCCC)C(O)=C3)O)C)CCCC)C(=C2)O)C
Compound: Svetamycin E
SMILES: Cl[C@@H]1CNN(C(=O)[C@@H](NC(=O)[C@@H]2N(N=C[C@H]([C@H]2O)O)C(=O)CO)C)[C@H](C1)C(=O)N3NC(CC[C@H]3C(=O)N[C@](C(=O)O)(CO)C)(C)C
Compound: 5-[(1R,4R,6R)-1,4-dihydroxy-2,6-dimethylcyclohex-2-en-1-yl]-3-methylpenta-2,4-dienoic acid
SMILES: O=C(O)C=C(C=C[C@@]1(O)C(=C[C@H](O)C[C@H]1C)C)C
Compound: 3,5-Dihydroxy-5-vinyl-2-cyclopenten-1-on
SMILES: O=C1C=C(N(C)C)[C@@](C1)(O)C=C
Compound: 4-[(3,4,5-tribromo-1H-pyrrol-2-yl)methyl]phenol
SMILES: OC1=CC=C(CC2=C(Br)C(Br)=C(Br)N2)C=C1
Compound: (E)-4-phenylbut-3-enamide
SMILES: O=C(N)C/C=C/C1=CC=CC=C1
Compound: Svetamycin F
SMILES: Br[C@@H]1CNN2C(=O)[C@@H](NC(=O)[C@H]3N(N=C[C@H]([C@H]3O)O)C(=O)COC([C@@](NC([C@H]4N(C([C@H]2C1)=O)NCCC4)=O)(CO)C)=O)C
Compound: Cylindrocyclophane E
SMILES: O=C(O[C@H]1C2=CC(O)=C([C@H](CCCC[C@@H](CC3=CC(=C([C@H](CCCC[C@@H]1C)CCCC)C(O)=C3)O)C)CCCC)C(=C2)O)C
Compound: DC-86-M
SMILES: O=C(O)C=1C2=NC=3C(=C(C=CC3)[C@@H](OC(=O)CO)C)N=C2C=CC1
Compound: 4-(2-methylpropyl)-7-propan-2-yl-1,2,3,5,6-pentathiepane
SMILES: S1SC(SSC(S1)CC(C)C)C(C)C
Compound: (+)-viridicatumtoxin B
SMILES: O=C1C2=C(O)C3=C(O)C=C(OC)C4=C3C(=C2C(=O)[C@@]5([C@@]1(O)C(O)=C(C(=O)C5)C(=O)N)O)C[C@@]64C(=CCCC6(C)C)C
Compound: (2E,4E,6R)-6-hydroxy-4,6-dimethyl-7-[4-(methylamino)phenyl]-7-oxohepta-2,4-dienamide
SMILES: O=C(N)/C=C/C(=C/[C@@](O)(C(=O)C1=CC=C(NC)C=C1)C)/C
Compound: Svetamycin G
SMILES: Br[C@@H]1CNN2C(=O)[C@@H](NC(=O)[C@H]3N(N=C[C@H]([C@H]3O)O)C(=O)COC([C@@](NC([C@H]4N(C([C@H]2C1)=O)NC(CC4)(C)C)=O)(CO)C)=O)C
Compound: Citreohybridonol
SMILES: O=C1O[C@H]2C[C@]3([C@@H]([C@]14C2C([C@@H](OC(=O)C)CC4)(C)C)C=C([C@]5(C(O)=C(C([C@@]35C(=O)OC)=O)C)C)C)C
Compound: Obscurolide A2
SMILES: O=C1OC(/C=C/C(O)C)C(C1)NC2=CC=C(C=O)C=C2
Compound: Crocacin
SMILES: O=C(N/C=C\C/C=C\C(=O)NCC(=O)OC)/C=C(/C=C/C(C(OC)C(C(OC)/C=C/C1=CC=CC=C1)C)C)\C
Compound: Spiromastixone C
SMILES: ClC1=C2OC3=C(C=C(O)C=C3CCC)OC(C2=C(CCC)C=C1O)=O
Compound: (2E,4E,6R)-7-[4-(dimethylamino)phenyl]-6-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide
SMILES: O=C(N)/C=C/C(=C/[C@@](O)(C(=O)C1=CC=C(N(C)C)C=C1)C)/C
Compound: Matsutakone
SMILES: O=C1[C@@]2(O)[C@@H]([C@H]3[C@@]4([C@@]1(CC[C@@H](C4)O)C)O3)CC[C@]5([C@H]2CC[C@@H]5[C@@H](C=C[C@@H](C(C)C)C)C)C
Compound: 3,10-dihydroxy-4,8-dimethoxy-6-methylbenzocoumarin
SMILES: O=C1OC=2C3=C(O)C=C(OC)C=C3C(C)=CC2C(=C1O)OC
Compound: Obscurolide A3
SMILES: O=C1OC(/C=C/C(O)C)C(C1)NC2=CC=C(CO)C=C2
Compound: Odilorhabdin NOSO-95A
SMILES: O=C(N[C@H](C(=O)NCCCCN)CC[C@H](O)CN)/C(/NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1N(C(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](O)CN)[C@@H](O)CN)CCCN)CCC1)CC=2NC=NC2)CC[C@H](O)CN)=C/CCN=C(N)N
Compound: (2E,4E,6R)-6-hydroxy-N,4,6-trimethyl-7-[4-(methylamino)phenyl]-7-oxohepta-2,4-dienamide
SMILES: O=C(NC)/C=C/C(=C/[C@@](O)(C(=O)C1=CC=C(NC)C=C1)C)/C
Compound: Penihydrone
SMILES: O=C1[C@H]([C@H](/C=C/C=C/CCC)C[C@H](C1)O)CO
Compound: Matsutoic acid
SMILES: O=C1[C@@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)CC1)(CCC(=O)O)C
Compound: Chlorohydroaspyrone B
SMILES: Cl[C@H]([C@@H](O)C=1C(=O)O[C@H](C)[C@H](C1)O)C
Compound: Odilorhabdin NOSO-95B
SMILES: O=C(N[C@H](C(=O)NCCCCN)CCCCN)/C(/NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1N(C(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](O)CN)[C@@H](O)CN)CCCN)CCC1)CC=2NC=NC2)CC[C@H](O)CN)=C/CCN=C(N)N
Compound: N(6)-formyl-L-lysine
SMILES: N[C@@H](CCCCNC=O)C(O)=O
Compound: Azoxymycin A
SMILES: O=C(NC(C(=O)O)CCC(=O)N)/C=C/C=C/C1=CC=C([N+]([O-])=NC2=CC=C(/C=C/C=C/C(=O)NC(C(=O)O)CCC(=O)N)C=C2)C=C1
Compound: Obscurolide A4
SMILES: O=C1OC(/C=C/C(O)C)C(C1)NC2=CC=C(COC)C=C2
Compound: Armochaetoglobin H
SMILES: O=C1[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C(=C[C@@H]3C=CC[C@H](C)C=C([C@H](C(CC1)=O)O)C)CO)CC=4C5=C(C=CC=C5)NC4
Compound: Cytochalasin J2
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14[C@H](O)C=CC(=C[C@H](CC=C[C@H]4[C@H](O)C(=C)[C@H]3C)C)C
Compound: Polyoxin H
SMILES: O=C1N(C=C(C)C(N1)=O)[C@@H]2O[C@H]([C@H](NC(=O)[C@@H](N)[C@H](O)[C@@H](O)COC(=O)N)C(=O)N3[C@@H](/C(=C/C)/C3)C(=O)O)[C@H]([C@H]2O)O
Compound: Azoxymycin B
SMILES: O=C(O)/C=C/C=C/C1=CC=C(N=[N+]([O-])C2=CC=C(/C=C/C=C/C(=O)N[C@H](C(=O)O)CCC(=O)N)C=C2)C=C1
Compound: Odilorhabdin NOSO-95C
SMILES: O=C(N[C@H](C(=O)NCCCCN)CCCCN)/C(/NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1N(C(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](O)CN)[C@@H](O)CN)CCCN)CCC1)CC=2NC=NC2)CCCCN)=C/CCN=C(N)N
Compound: Sterebin P1
SMILES: O1[C@@]2([C@@H](O)[C@H](O)[C@H]3C(CCC[C@@]3([C@H]2C[C@H]([C@@]1(CC)C)O)C)(C)C)C
Compound: Cytochalasin J3
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14[C@H](O)C[C@H]5C(=C[C@H](C[C@@H]6[C@@H]5[C@H]4[C@H](O6)C([C@H]3C)=C)C)C
Compound: Roubetaelianone A
SMILES: O=C1C=2C3=C(C(O)=CC(=C3C(OCC=C(C)C)=CC2O)C)C(C1(O)O)=O
Compound: N(6)-glycyl-L-lysine
SMILES: NCC(=O)NCCCC[C@H](N)C(O)=O
Compound: Xylaranic acid
SMILES: O=C(O)C([C@@H]1[C@H](O)C=C2C[C@@H](O)C[C@@H]([C@]2(C1)C)C)CO
Compound: 11-hydroxysclerosporin
SMILES: O=C(O)C1=CC[C@H](C(O)(C)C)[C@@H]2[C@H]1CCC(=C2)C
Compound: Cyclomarin B
SMILES: O=C1N([C@H](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]1[C@H](O)C=2C3=C(C=CC=C3)N(C2)C([C@H]4OC4)(C)C)=O)[C@@H](C=C(C)C)C)=O)CC(C)C)C)=O)C(C)C)[C@H](OC)C5=CC=CC=C5)C)CC(C)C)C
Compound: Sterebin P2
SMILES: O1[C@@]2([C@@H](O)[C@H](O)[C@H]3C(CCC[C@@]3([C@H]2C[C@H]([C@]1(CC)C)O)C)(C)C)C
Compound: Odilorhabdin NOSO-95179
SMILES: O=C(O)/C(/NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1N(C(=O)[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](O)CN)C)CCCN)CCC1)CC=2NC=NC2)CCCCN)=C/CCN=C(N)N
Compound: Cladosporol F
SMILES: O=C1C2=C(O)C=CC=C2[C@H](C3=C4C(=C(O)C=C3)[C@@H](OC)CCC4=O)CC1
Compound: EI-1941-2
SMILES: O=C1O[C@@H](CC2=C1[C@@H](O)[C@@H]3O[C@@H]3C2=O)CCC
Compound: (+)-RK-286c
SMILES: O=C1NCC=2C1=C3C=4N([C@@H]5O[C@](N6C4C2C7=C6C=CC=C7)([C@H](OC)[C@@H](C5)O)C)C8=C3C=CC=C8
Compound: Phomachalasin B
SMILES: O=C1C=CC2=C(C(=O)CCC[C@H](CC=CC3[C@@]14C(=O)N[C@H](C4[C@H](C)C([C@H]3O)=C)CC5=CC=CC=C5)C)C(OC)C6C2(C(=O)N)C(O)C6O
Compound: Olimycin A
SMILES: O=C1O[C@H](CC=C[C@@H](CCC(C=2C=3C(C=4[C@]1(C=CC(=O)NC4C(=O)C3C=C(C)C2O)C)=O)=O)CC)CC(C)C
Compound: Cladosporol G
SMILES: O=C1C2=C(O)C=CC=C2[C@H](C3=C4C(=C(O)C=C3)[C@H](OC)CCC4=O)CC1
Compound: Roseopurpurin E
SMILES: O=C1C(=C(O)[C@H](O)[C@@]([C@H]1OC2=C(C(=CC(=C2C)O)C)C(=O)O)(OC)C)C
Compound: Nocapyrone D
SMILES: O=C1C(=C(OC(=C1C)CCCC[C@@H](C(=O)C)C)OC)C
Compound: Anthcolorin C
SMILES: O=C1N(C=2C=CC=CC2[C@H]1C[C@H]3C(=C)[C@@]4([C@H]([C@]5([C@@H](O[C@@H](C(O)(C)C)CC5)CC4)C)CC3)C)C(C=C)(C)C
Compound: Olimycin B
SMILES: O=C1O[C@H]([C@@H](O)C=C[C@@H](CCC(C=2C=3C(C=4[C@]1(C=CC(=O)NC4C(=O)C3C=C(C)C2O)C)=O)=O)CC)CC(C)C
Compound: Cis-2-Hydroxymethyl-3-methylcyclopentano
SMILES: O=C1[C@@H]([C@H](C)CC1)CO
Compound: Orirubenone E
SMILES: O=C(C1=C(O)C=CC(=C1)O)/C=C(/CCC(=O)OC)\C
Compound: Chartarutine A
SMILES: O=C1NCC2=C1C=C(O)C(=C2O)C/C=C(\CC/C=C(\CC[C@H](O)C(O)(C)C)/C)/C
Compound: Cladosporol H
SMILES: O=C1C2=C(C(=CC=C2O)[C@H]3C4=C(C(O)=CC=C4)C(=O)CC3)C(=O)CC1
Compound: Ro 09-1679
SMILES: O=C(O)/C=C/C(=O)NC(C(=O)NC(C(=O)NC(C=O)CCCN=C(N)N)CC(C)C)CCCN=C(N)N
Compound: N(6)-lipoyl-L-lysine
SMILES: N[C@@H](CCCCNC(=O)CCCCC1CCSS1)C(O)=O
Compound: Nitrosporeunol F
SMILES: O1C2=C(C=C(O)C(=C2)C)CC[C@]1(CC/C=C(/CCC=C(C)C)\C)C
Compound: Myxothiazol S1
SMILES: S1C(=NC(=C1)/C=C/[C@H](OC)[C@H](C(=O)CC(=O)N)C)C=2N=C([C@H](O)C)SC2
Compound: Cladosporol I
SMILES: O=C1C2=C(O)C=CC(=C2[C@@H](O)CC1)[C@H]3C4=C(C(O)=CC=C4)C(=O)CC3
Compound: Chartarutine B
SMILES: O=C1NCC2=C1C=C(O)C(=C2O)C/C=C(\CC/C=C(\CCC=C(C)C)/C)/C
Compound: Aurantinin C
SMILES: O=C1OC(=O)C2C(C(C(C)=CC3C2CCC(C3O[C@H]4O[C@H]([C@H](O)C([C@@H]4O)O)C)C)/C=C/C=C/C=C(/CC(CC(O)C(C(=O)O)C)C)\C)=C5C(=C1C)CC(O)C5C
Compound: Salinosporamide G
SMILES: O=C1N[C@]2(C(=O)O[C@]2([C@@H]1C)C)[C@@H](O)[C@@H]3C=CCCC3
Compound: Fomitellic acid A
SMILES: O=C1C2=C([C@]3([C@H](O)C[C@@H](C([C@@H]3C1)(C(=O)O)C)O)C)[C@H](O)C[C@]4([C@]2(CC[C@@H]4C(CCC=C(C)C)C)C)C
Compound: Cladosporol J
SMILES: O=C1C2=C(O)C=CC=C2[C@H](C3=C4C(=C(O)C=C3)[C@H](O)CCC4=O)CC1
Compound: Pyrenochaetic acid A
SMILES: O=C(O)C1=CC(OC)=C(C(=O)/C=C/C)C(=C1)C
Compound: Chartarutine C
SMILES: S(=O)(=O)(OC1=C(C(O)=CC2=C1CNC2=O)C/C=C(\CC/C=C(\CCC=C(C)C)/C)/C)O
Compound: Aurantinin D
SMILES: O=C1OC(=O)C2C(C(C(C)=CC3C2CCC(C3O[C@H]4O[C@H]([C@H](O)C([C@@H]4O)=O)C)C)/C=C/C=C/C=C(/CC(CC(O)C(C(=O)O)C)C)\C)=C5C(=C1)CC(O)C5C
Compound: 6-[(7S,8R)-8-propyloxiran-1-yl]-4-methoxy-pyran-2-one
SMILES: O=C1OC(=CC(=C1)OC)C2OC2CCC
Compound: LP237-F8
SMILES: O=C(N1[C@H](C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)N[C@H](C(=O)NC(C(=O)N[C@](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](CO)CC(C)C)C)CCC(=O)N)(CCC)CC)(C)C)CCC(=O)N)CCC(=O)N)(C)C)CC2=CC=CC=C2)CCC1)C(NC(=O)CCCCCCC)(C)C
Compound: Chartarutine E
SMILES: O=C1NCC2=C1C=C3OC(CC/C=C(\CCC(O)C(O)(C)C)/C)(C)C=CC3=C2O
Compound: Pleurocin B
SMILES: O=C1[C@@]2(O)[C@@H]([C@H]3[C@@]4([C@@]1(CC[C@@H](C4)O)C)O3)CC[C@]5([C@H]2CC[C@@H]5[C@@H](CC[C@@H](C(C)C)C)C)C
Compound: Nevaltophin B
SMILES: O=C(N([C@H](C(=O)NCCC1=CC=CC=C1)C(C)C)C)C(=O)C(C)C
Compound: Legonmycin B
SMILES: O=C1C(=C(NC(=O)CCC(C)C)N2[C@]1(O)CCC2)C
Compound: (22E)-3b-Hydroxy-ergosta-5,22-dien-7-one
SMILES: O=C1C=C2[C@@](CC[C@@H](C2)O)(C)[C@@H]3[C@@H]1[C@H]4[C@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)CC4)(C)CC3
Compound: Eringiacetal B
SMILES: O=C1C2=C([C@]3(CC[C@@H](CC3=C1)O)C)CC[C@]4(O[C@]2(O)CC[C@@H]4[C@@H](/C=C/[C@@H](C(C)C)C)C)C
Compound: Chartarutine F
SMILES: O=C1NCC2=C1C=C(O)C3=C2OC(C=C3)(CC/C=C(\CCC(O)C(O)(C)C)/C)C
Compound: Cordycedipeptide A
SMILES: O=C1N[C@H](C(=O)N[C@H]1[C@H](CC)C)CC(=O)N
Compound: Nevaltophin C
SMILES: O=C(N[C@H](C(=O)NCCC1=CC=CC=C1)C(C)C)C(=O)C(C)C
Compound: [Asp3, ADMAdda5, Dhb7] microcystin HtyR
SMILES: O=C1N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)CC(=O)N[C@@H](CCCN=C(N)N)C(N[C@H]([C@@H](C(N[C@H](CCC(NC1=CC)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC(=O)C)CC2=CC=CC=C2)C)/C)=O)CCC3=CC=C(O)C=C3)C
Compound: Circumcin C
SMILES: O=C([C@@H](O)CC1=CC=CC=C1)CC2=CC=CC=C2
Compound: Chartarutine G
SMILES: O=C1NCC2=C1C=C3O[C@](CC/C=C(\CCC=C(C)C)/C)(C)C=CC3=C2O
Compound: Nevaltophin D
SMILES: O=C(N([C@H](C(=O)NCCC=1C2=C(C=CC=C2)NC1)C(C)C)C)C(=O)C(CC)C
Compound: 3beta,14beta-dihydroxyergosta-5,8,22-trien-7-one
SMILES: O=C1C2=C([C@]3(CC[C@@H](CC3=C1)O)C)CC[C@]4([C@]2(O)CC[C@@H]4[C@@H](/C=C/[C@@H](C(C)C)C)C)C
Compound: Petromindole
SMILES: O[C@H]1C([C@@H]2[C@@]([C@H]3[C@]([C@@H]4[C@@](C5=C6C(=CC=C5)NC=C6C4)(C)CC3)(C)CC2)(C)CC1)(C)C
Compound: (E,E)-4-ethyl-2,4-hexadienamide
SMILES: O=C(N)/C=C/C(=C/C)/CC
Compound: 1,4-diphenyl-2,3-butanediol
SMILES: O[C@H]([C@@H](O)CC1=CC=CC=C1)CC2=CC=CC=C2
Compound: Guanacastepene J
SMILES: O=C1OC2=C3C(=O)[C@H](OC)[C@@H]([C@]3(CC[C@]4(C2=C1[C@@H](O)CC4)C)C)C(C)C
Compound: Nevaltophin E
SMILES: O=C(N([C@H](C(=O)NCCC=1C2=C(C=CC=C2)NC1)C(C)C)C)C(=O)C(C)C
Compound: Chartarutine H
SMILES: O=C1NCC2=C1C=C(O)C3=C2O[C@](C=C3)(CC/C=C(\CCC=C(C)C)/C)C
Compound: Pleurocin A
SMILES: O=C1[C@@]2(O)[C@@H]([C@H]3[C@@]4([C@@]1(CC[C@@H](C4)O)C)O3)CC[C@]5([C@H]2CC[C@@H]5[C@@H](/C=C/[C@@H](C(C)C)C)C)C
Compound: Germicidin C
SMILES: O=C1OC(=CC(=C1C)O)[C@H](CC)C
Compound: Cytosporone E
SMILES: O=C1O[C@@H](CCCCCCC)C2=C1C=C(O)C(=C2O)O
Compound: Metacridamide A
SMILES: O=C1N[C@H](C(=O)O[C@@H]([C@H](C=C(C)[C@H]([C@H](C=C([C@@H]([C@H](C=C1C)C)O)C)C)OC(=O)C)C)[C@H](C[C@H](CC)C)C)CC2=CC=CC=C2
Compound: Cytosporone A
SMILES: O=C(O)CC1=C(C(O)=CC(=C1)O)C(=O)CCCCCCC
Compound: Cerebroside E
SMILES: O=C(N[C@H]([C@H](O)/C=C/CC/C=C(/CCCCCC)\C)CO[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@H]1O)O)CO)[C@H](O)CCCCCCCCCCCCCCCC
Compound: Comnostin E
SMILES: O=C(O)C1=CC(=C(O)C=C1)C[C@]2(C3[C@@](C4[C@@]([C@H](C(=O)C)CC4)(C)CC3)(CC[C@H]2C)C)C
Compound: N(6)-methyladenosine
SMILES: CNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Compound: (+/-)-conipyrrolidone D
SMILES: O=C1NC(=CC2=CC=C(O)C=C2)C(=C1C(=O)[C@H]3[C@H]4[C@@H](C=C[C@@H]3C)CC(C)=CC4)O
Compound: Nevaltophin F
SMILES: O=C(N[C@H](C(=O)NCCC=1C2=C(C=CC=C2)NC1)C(C)C)C(=O)C(C)C
Compound: Simocyclinone D4
SMILES: O=C1OC2=C(C=CC(=C2)O)C(=C1NC(=O)/C=C/C=C/C=C/C=C/C(=O)O[C@H]3[C@H](OC(=O)C)[C@H](O[C@H](C3)C4=C(O)C5=C(C(=O)C67C8(O)C(=O)C=C(C)CC8(O)CC(C7(C5O)O6)O)C=C4)C)O
Compound: Cytosporone C
SMILES: O=C1O[C@H](C=2C(O)=CC(=CC2C1)O)CCCCCCC
Compound: Conipyridoin E
SMILES: O=C1NC(=CC2=CC=C(O)C=C2)C(=C1C(=O)[C@@H]3[C@@H]4[C@@H](C=C[C@@H]3C)C[C@@H](C)CC4)O
Compound: 3-[2-[2-hydroxy-3-methylphenyl-5-(hydroxymethyl)]-2-oxoethyl]glutarimide
SMILES: O=C1NC(=O)CC(C1)CC(=O)C2=C(O)C(=CC(=C2)CO)C
Compound: (1S,3aR)-jadomycin Ala
SMILES: O=C1C=2N3[C@H](OC([C@@H]3C)=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: Le-pyrrolopyrazine A
SMILES: O=C1N2C(=CN=C1C(C)C)CCC2
Compound: Carolic acid
SMILES: O=C1O[C@@H](C)C(C1=C2OCCC2)=O
Compound: Sordarin C
SMILES: O=C(O)[C@]12C(=C[C@@H]3[C@]1(C[C@H]4[C@H]([C@@]2(C=O)C3)CC[C@H]4C)CO[C@@H]5O[C@@H]([C@@H](OC)[C@H]([C@@H]5O)O)C)C(CO)C
Compound: Cyclo-(2-hydroxy-Pro-Gly)
SMILES: O=C1NCC(=O)N2[C@]1(O)CCC2
Compound: Lynamicin G
SMILES: ClC1=CC2=C(NC=C2C=3C(=C(C(=O)OC)N(C3C(=O)OC)C)C=4C5=C(C=CC(=C5)Cl)NC4)C=C1
Compound: Conipyridoin F
SMILES: O=C1NC(=CC2=CC=C(O)C=C2)C(=C1C(=O)[C@H]3[C@H]4[C@H](C=C[C@H]3C)C[C@@H](C)CC4)O
Compound: Le-pyrrolopyrazine B
SMILES: O=C1N2C(=CN=C1CC(C)C)CCC2
Compound: Fumigaclavine D
SMILES: O=C(O[C@@H]1[C@@H]2C3=C4C(NC(=C4C[C@H]2NC[C@H]1C)C(C=C)(C)C)=CC=C3)C
Compound: 3alpha-acetylpolyporenic acid A
SMILES: O=C(O)[C@H](C(=C)CCC([C@@H]1[C@@]2([C@@](C3=C([C@@]4(C(C([C@H](OC(=O)C)CC4)(C)C)CC3)C)C[C@@H]2O)(C)CC1)C)C)C
Compound: (S)-dihydro-5-[(S)-hydroxyphenylmethyl]-2(3H)-furanone
SMILES: P=C1O[C@H]([C@@H](O)C2=CC=CC=C2)CC1
Compound: Rhodopeptin C3
SMILES: O=C1N[C@@H](CC(=O)NCC(N[C@H](C(N[C@H]1C(C)C)=O)CCCN)=O)CCCCCCCCC(C)C
Compound: (+/-)-didymellamide E
SMILES: O=C1NC=C(C2=CC=C(O)C=C2)C(=C1C(=O)[C@H]3[C@H]4[C@H](C=C[C@H]3C)CC(C)=CC4)O
Compound: Le-pyrrolopyrazine C
SMILES: O=C1N2C(=CN=C1[C@H](CC)C)CCC2
Compound: Fumigaclavine E
SMILES: O[C@@H]1[C@@H]2C3=C4C(NC(=C4C[C@H]2N(C)C[C@H]1C)C(C=C)(C)C)=CC=C3
Compound: 4,6-Dihydroxy-5-methylphthalide
SMILES: O=C1OCC2=C1C=C(O)C(=C2O)C
Compound: Cordycommunin
SMILES: O=C1OC(CCCC(=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)C)=O)CC2=CC=C(O)C=C2)=O)CCC(=O)N)=O)C)C)[C@H](O)C)CCCCCCCCC
Compound: (+)-didymellamide B
SMILES: O=C1NC=C(C2=CC=C(O)C=C2)C(=C1C(=O)[C@@H]3[C@@H]4[C@@H](C=C[C@@H]3C)C[C@@H](C)CC4)O
Compound: Chaetoaurin
SMILES: O=C1C2=C(O)C(=C(OC)C=C2OC(=C1)C)CC(C(=O)CC(O)C)C
Compound: Totopensamide C
SMILES: ClC1=C(O)C(=C(OS(=O)(=O)O)C=C1[C@H]2NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)CC(=O)C(CC(CC(C(O)C(C(OC3O[C@@H]([C@@H](OC)[C@@H]([C@H]3O)O)CO)C(O)C)C)C)C)C)[C@H](O)C)C)[C@H](NC(=O)CNC([C@@H](NC2=O)[C@H](CC)C)=O)C)C
Compound: Fumigaclavine F
SMILES: O[C@H]1[C@H]2C3=C4C(NC(=C4C[C@H]2N(C)C[C@@H]1C)C(C=C)(C)C)=CC=C3
Compound: Rhodobactin
SMILES: O=C1N(O)CCCC1NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C2=C(O)C(O)=CC=C2)CCCNC(=O)C3=C(O)C(O)=CC=C3)CCCNC(=O)N)CCCNC(=O)N
Compound: (+)-N-hydroxyapiosporamide
SMILES: O=C1N(O)C=C([C@@]2(O)[C@H]3O[C@H]3[C@@H](O)CC2)C(=C1C(=O)[C@@H]4[C@@H]5[C@@H](C=C[C@@H]4C)C[C@@H](C)CC5)O
Compound: 3-[(2S,5S)-5-benzyl-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide
SMILES: O=C1N[C@H](C(=O)N[C@H]1CC2=CC=CC=C2)CCC(=O)NCCC3=CC=CC=C3
Compound: Fumigaclavine H
SMILES: O=C=O.N1[C@H]2[C@H](C3=C4C(=CC=C3)NC(=C4C2)C(C=C)(C)C)[C@H](C)[C@H](C1)C
Compound: Chaetoglobosin Y
SMILES: O=C1C(=C[C@H](CC=C[C@@H]2[C@]3(C(CC[C@@H]1O)=O)C(=O)N[C@H]([C@@H]3[C@H](C)[C@H](C2=O)C)CC=4C5=C(C=CC=C5)NC4)C)C
Compound: Combamide A
SMILES: O=C1NCCC[C@@H]2NC(=O)C(C2=O)=C(O)C=CC=CC[C@H]3[C@H](C=CC=C1)C[C@@H]4C[C@@]([C@H]([C@H]34)C)(O)C(=O)C
Compound: Combamide B
SMILES: O=C1NCCC[C@@H]2NC(=O)C(C2=O)=C(O)C=CC=CC[C@H]3[C@H](C=CC=C1)C[C@@H]4C[C@@]([C@H]([C@H]34)C)(O)C(O)C
Compound: (+/-)-conipyrrolidone A
SMILES: O=C1N[C@H](CC2=CC=C(O)C=C2)C(C1=C(O)[C@H]3[C@H]4[C@H](C=C[C@H]3C)CC(C)=CC4)=O
Compound: Chivosazol
SMILES: O=C1OC(C(C=CC=CC=CC(O)CC(OC)C(C=2OC=C(C=CC=CC(C(C=C(C=CC=CC=C1)C)C)O[C@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3OC)OC)C)N2)C)C)C(C(O)CC(O)C)C
Compound: Flammulinolide C
SMILES: O=C1OCC2=C1[C@@]3(O)C(=O)C(C)(C)C[C@H]3C[C@H]2C
Compound: Marinoquinoline K
SMILES: N=1C=2C(C=3C=CNC3C1)=CC=CC2
Compound: Chaetocuprum
SMILES: O=C1C2(OC(=O)C(C2)NC(=O)/C(=C/CCCCCCCCCCC(=O)O)/C)C3OC3C4C1O4
Compound: NW-G05
SMILES: ClC1=CC=2N[C@H]3N4C(=O)[C@@H]5N(NCCC5)C(=O)[C@@H](NC(=O)[C@@H]6N(NCCC6)C([C@H]7N(C([C@H](NC([C@@H]4C[C@]3(C2C=C1)O)=O)C(C)C)=O)NCCC7)=O)C
Compound: 5-hydroxymethylasterric acid
SMILES: O=C(OC)C1=C(OC2=C(C(O)=CC(=C2)CO)C(=O)O)C(OC)=CC(=C1)O
Compound: Didymellamide F
SMILES: O=C1N(O)C=C([C@@]2(O)[C@H]3O[C@H]3[C@@H](O)CC2)C(=C1C(=O)[C@@H]4[C@@H]5[C@@H](C=C[C@@H]4C)C[C@H](C)CC5)O
Compound: Combamide C
SMILES: O=C1NCCC[C@@H]2NC(C(=C[C@@H]3[C@@H]1C=C[C@@H]4[C@@H](C[C@H]5[C@@H]4C[C@@H]6C[C@H]([C@H]([C@H]56)C)C(=O)C)C=C3)C2=O)=O
Compound: Marinoquinoline J
SMILES: N=1C=2C(C3=C(C=CC=C3)N(C2)C)=CC1
Compound: Cytochalasin B6
SMILES: O=C1O[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C([C@H]([C@@H]3C=CC[C@H](C)CCCC(CC1)=O)O)=C)CC4=CC=CC=C4
Compound: Serratamolide F
SMILES: O=C1OC(CC(=O)N[C@H](C(=O)OC(CC(N[C@H]1CO)=O)CCCCCC)CO)CCCCCCC
Compound: Gloeophyllic acid A
SMILES: O=C(O)[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)CCC(OC)OC
Compound: Didymellamide G
SMILES: O=C1N(O)C=C([C@@]2(O)[C@H]3O[C@H]3[C@@H](O)CC2)C(=C1C(=O)[C@@H]4[C@@H]5[C@@H](C=C[C@@H]4C)CC(C)=CC5)O
Compound: Pactamide C
SMILES: O=C1NCCC[C@@H]2NC(=O)C(C2=O)=C(O)C=CC=CC[C@H]3[C@H](C=CC=C1)C[C@@H]4C[C@@H]([C@H]([C@H]34)C)CC
Compound: (7S,11S)-(+)-12-Hydroxysydonic acid
SMILES: O=C(O)C1=CC(O)=C([C@](O)(CCCC(CO)C)C)C=C1
Compound: Cytochalasin B5
SMILES: O=C1O[C@@]23C(=O)N[C@H]([C@@H]2C(C)=C([C@H]([C@@H]3C=CC[C@H](C)CCC[C@H](CC1)O)O)C)CC4=CC=CC=C4
Compound: 2-[[(E)-3-[[3-[4-[[2-[2-amino-1-[5-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-3-methoxyoxolan-2-yl]-2-oxoethoxy]-3,4-dihydroxy-3,4-dihydro-2H-pyran-6-carbonyl]amino]phenyl]-2,3-dihydroxypropanoyl]amino]prop-2-enoyl]amino]acetic acid
SMILES: O=C1N(C=CC(N1)=O)C2OC(C(OC3OC(C(=O)NC4=CC=C(C(O)C(O)C(=O)N/C=C/C(=O)NCC(=O)O)C=C4)=CC(C3O)O)C(=O)N)C(C2O)OC
Compound: Ketomemicin B3
SMILES: O=C(O)[C@H](CC1=CC=CC=C1)CC(=O)[C@@H](C(=O)[C@@H](N=C(N)N)CCCN=C(N)N)CC2=CC=CC=C2
Compound: Enterocin A
SMILES: O=C(NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C=O)CC(=O)N)CC1=CC=C(O)C=C1)CC2=CC=C(O)C=C2)CCCCN)CO)CC=3NC=NC3)C(NC(=O)C(N)C(O)C)C(O)C
Compound: Plorantinone B
SMILES: O=C1C(=C2[C@@](CC2)(C)[C@@]3(C1C[C@](CO)(C)C3)O)C
Compound: Didymellamide H
SMILES: O=C1N(O)C=C(C2=C(O)C3OC3CC2)C(=C1C(=O)[C@@H]4[C@@H]5[C@@H](C=C[C@@H]4C)CC(C)=CC5)O
Compound: Cytochalasin B4
SMILES: O=C1O[C@@]23C(=O)N[C@H]([C@@H]2C(C)=C([C@H]([C@@H]3C=CC[C@H](C)CCCC(CC1)=O)O)C)CC4=CC=CC=C4
Compound: Napyradiomycin D
SMILES: Cl[C@@]12C(=O)C3=C(O)C4=C5OCC(C4)=CCC(=CC[C@]1(OC(C)(C)[C@@H](C2)Cl)C(=O)C3=C5)C
Compound: Ketomemicin B4
SMILES: O=C(O)[C@H](CC1=CC=CC=C1)CC(=O)[C@H](C(=O)[C@@H](N=C(N)N)CCCN=C(N)N)CC2=CC=CC=C2
Compound: Cytochalasin Z15
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@]1(O)[C@@H](/C=C/C[C@@H]([C@@H](O)C(=O)C)C)[C@H](O)C(C)=C3C
Compound: Plorantinone C
SMILES: O=C1C(=C2[C@@](C[C@@H]2O)(C)[C@@]3(C1C[C@](CO)(C)C3)O)C
Compound: (+/-)-conipyrrolidone B
SMILES: O=C1N[C@@H](CC2=CC=C(O)C=C2)C(C1=C(O)[C@H]3[C@H]4[C@H](C=C[C@H]3C)CC(C)=CC4)=O
Compound: Cytochalasin B3
SMILES: O=C1O[C@@]23C(=O)N[C@H]([C@@H]2C(C)=C([C@H]([C@@H]3C=CC[C@H](C)CCCC(C=C1)=O)O)C)CC4=CC=CC=C4
Compound: Rhizopodin
SMILES: O=C1O[C@H](C(C(O)CC=2OC=C(N2)[C@@H](OC)CC=CC=C[C@H](OC)C[C@H](O)CC(=O)O[C@H](C(C(CC3=NC([C@H](CC=CC=C[C@@H](C[C@@H](C1)O)OC)OC)=CO3)O)(C)C)C[C@H](OC)[C@H](CCC(=O)[C@@H]([C@H](OC)C/C=C/N(C=O)C)C)C)(C)C)C[C@H](OC)[C@H](CCC(=O)[C@@H]([C@H](OC)C/C=C/N(C=O)C)C)C
Compound: Gloeophyllin B
SMILES: O=C(O)[C@@]1([C@@H](O)CC[C@]2([C@H]1CCC3=C2C[C@@H](OC(=O)C)[C@]4([C@H]3CC[C@@H]4[C@@H](CCC(=C)C(C)C)C)C)C)C
Compound: Aspercryptin A1
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](CO)CCCCCCCCCC)CC(=O)N)CCCCCC)[C@H](CC)C)[C@H](NC(=O)[C@H](N)CO)[C@H](O)C
Compound: Phoslactomycin I
SMILES: P(=O)(OC(C(O)(C=CC1OC(=O)C=CC1C)C)CC(O)C=CC=CC2CCCCC2)(O)O
Compound: (+/-)-conipyrrolidone C
SMILES: O=C1NC(=CC2=CC=C(O)C=C2)C(=C1C(=O)[C@H]3[C@H]4[C@H](C=C[C@H]3C)CC(C)=CC4)O
Compound: Nannocystin A
SMILES: ClC1=C(O)C(Cl)=CC(=C1)C[C@H]2NC(=O)[C@@H](N(C(=O)[C@@]3(O[C@H]3C[C@@H](OC)C(C)=CC=C[C@H]([C@H](OC([C@@H](NC2=O)C(O)(C)C)=O)C4=CC=CC=C4)C)C)C)[C@H](CC)C
Compound: Integracide G
SMILES: O=C(O[C@H]1C([C@@H]2[C@@](C3=C(C4=CC[C@H]([C@]4(C)[C@@H]([C@H]3O)OC(=O)C)[C@H](CCC(=C)C(C)C)C)CC2)(C)C[C@@H]1O)(C)C)CCCCCCCCCO
Compound: Aspercryptin A2
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](CO)CCCCCCCCCC)CC(=O)N)CCCCCC)[C@H](CC)C)[C@H](NC(=O)[C@H](N)C)[C@H](O)C
Compound: Phellilane L
SMILES: O[C@]([C@@H]1CC=C(C)CC1)([C@H]2[C@H](C(O)(C)C)C2)C
Compound: Entonalactam A
SMILES: O=C1N[C@H](C2=C(O)C(OC)=CC(=C2)C)C=3C1=C(OC)C=C(O)C3
Compound: 6-hexyl-3-methyl-(3S,3aS,6R,6aR)-perhydrofuro[3,4-b]furan-2,4-dione
SMILES: O=C1O[C@H](CCCCCC)[C@H]2[C@@H]1[C@@H](C(=O)O2)C
Compound: Verticilide A1
SMILES: O=C1O[C@@H](C(=O)N([C@@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(N([C@@H](C(O[C@@H](C(N([C@H]1C)C)=O)CCCCC)=O)C)C)=O)CCCCC)C)C)CCCCC)C)C)CCCCC
Compound: SMTP-2
SMILES: O=C1N(CC2=C1C=C(O)C3=C2OC(C(O)C3)(CC/C=C(/CCC(O)C(O)(C)C)\C)C)CCO
Compound: Asperorydine F
SMILES: O=C1N(C(=O)CC(=O)C)C(C)(C)[C@H]2[C@@H]1C=3C4=C(C=CC=C4NC3)C2
Compound: Entonalactam B
SMILES: O=C1N[C@H](C2=C(OC)C(OC)=CC(=C2)C)C=3C1=C(OC)C=C(O)C3
Compound: Ceriponol A
SMILES: O[C@H]1C(CC=2[C@@H]1[C@H](CC[C@@H](C2CO)CO)C)(C)C
Compound: Verticilide A2
SMILES: O=C1OC(C(=O)N([C@H](C(=O)OC(C(=O)N[C@@H](C(=O)OC(C(N([C@H](C(OC(C(N([C@@H]1C)C)=O)CCCCC)=O)C)C)=O)CCCCC)C)CCCCC)C)C)CCCCC
Compound: Rimosamide A
SMILES: O=C(O[C@H]([C@H]1N(C(=O)[C@@H](N)C(CC)C)CC[C@H]1OC(=O)C)CC(=O)O)[C@@H](NC(=O)CNC(=O)C(C)C)CC2=CC=CC=C2
Compound: Entonalactam C
SMILES: O=C1N[C@@](O)(C2=C(OC)C(OC)=CC(=C2)C)C=3C1=C(OC)C=C(O)C3
Compound: Asperorydine I
SMILES: O=C1C2=C(NC)C=CC=C2C[C@@H]3[C@H]1C(=O)N(C(=O)CC(=O)C)C3(C)C
Compound: 12-(4-aminophenyl)-10-hydroxy-6-(1-hydroxyethyl)-7,9-dimethyl-12-oxo-dodeca-2,4-dienoic acid
SMILES: O=C(O)/C=C/C=C/C(C(O)C)C(CC(C(O)CC(=O)C1=CC=C(N)C=C1)C)C
Compound: Cyanopeptoline CB071
SMILES: ClC1=C(OC)C=CC(=C1)C[C@@H]2N(C(=O)C(N3C(=O)C(NC(=O)[C@H](CCCN=C(N)N)NC([C@@H]([C@H](OC(C(NC2=O)C(C)C)=O)C)NC(=O)[C@@H](NC(=O)CCCCC)CCC(=O)O)=O)CC[C@H]3O)[C@H](CC)C)C
Compound: Rimosamide B
SMILES: O=C(O[C@H]([C@H]1N(C(=O)[C@@H](N)C(C)C)CC[C@H]1OC(=O)C)CC(=O)O)[C@@H](NC(=O)CNC(=O)C(C)C)CC2=CC=CC=C2
Compound: Baumannoferrin A
SMILES: O=C1N(C(O)(C(=O)O)CC1)C(C(=O)O)CCNC(=O)CC(C(=O)O)C(=O)NCCCN(O)C(=O)/C=C/CCCCCCC
Compound: 44-Homooligomycin A
SMILES: O=C1OC2C(C3(OC(C2C)CCC(C=CC=CCC(C)C(C(C(C(C(C(C(C(C(C(C=C1)C)O)C)=O)C)O)C)=O)(O)C)O)CC)OC(C(C)CC3)CC(O)C)CC
Compound: Asperorydine J
SMILES: O=C1C2=C(NC)C=CC=C2C[C@@H]3[C@H]1C(=O)N(C(=O)CC(=O)OC)C3(C)C
Compound: Fengycin C
SMILES: O=C1OC2=CC=C(CC(NC(=O)C(NC(=O)C(NC(=O)CC(O)CCCCCCCCCCCCC)CCC(=O)O)CCCN)C(=O)NC(C(=O)NC(C(=O)NC(C(N3C(C(NC(C(NC(C(NC1C(CC)C)=O)CC4=CC=C(O)C=C4)=O)CCC(=O)N)=O)CCC3)=O)C)CCC(=O)O)C(O)C)C=C2
Compound: Rimosamide C
SMILES: O=C(O[C@H]([C@H]1N(C(=O)[C@@H](N)C(CC)C)CCC1)CC(=O)O)[C@@H](NC(=O)CNC(=O)C(C)C)CC2=CC=CC=C2
Compound: Cycloarthropsadiol C
SMILES: O=C1C2(O[C@@]3(O)CC(O2)[C@H](C1[C@H]3O)/C=C/C)C
Compound: Crisamicin A
SMILES: O=C1C2=C(C(=O)C3=C1C(OC4C3OC(=O)C4)C)C(O)=CC(=C2)C5=CC(O)=C6C(=O)C=7C8OC(=O)CC8OC(C7C(C6=C5)=O)C
Compound: Asperorydine K
SMILES: O=C1C2=C(NC)C=CC=C2C[C@@H]3[C@H]1[C@@H]4N(C(=O)C(=C4O)C(=N)C)C3(C)C
Compound: Annulohypoxyboverin
SMILES: O=C1C=2C(=O)OCC2C[C@@H]3[C@@]1(OC(=O)[C@H]3C(O)CCCCC)C
Compound: Gageopeptin A
SMILES: O=C1O[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](CC(C)C)C(N[C@H](C(N[C@@H](C(N[C@H](C(N[C@@H]1CC(C)C)=O)CC(C)C)=O)CC(=O)O)=O)C)=O)C(C)C)CCC(=O)O)CCCCCCCCC(CC(CC)C)C
Compound: Cholesteryl-6-O-tetradecanoyl-a-D-glucopyranoside
SMILES: O=C(OCC1OC(O[C@@H]2CC3=CC[C@H]4[C@H]5[C@]([C@@H]([C@@H](CCCC(C)C)C)CC5)(C)CC[C@@H]4[C@@]3(C)CC2)C(O)C(C1O)O)CCCCCCCCCCCCC
Compound: Rimosamide D
SMILES: O=C(O[C@H]([C@H]1N(C(=O)[C@@H](N)C(C)C)CCC1)CC(=O)O)[C@@H](NC(=O)CNC(=O)C(C)C)CC2=CC=CC=C2
Compound: Gageopeptin B
SMILES: O=C1O[C@@H](CC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](CC(C)C)C(N[C@H](C(N[C@@H](C(N[C@H](C(N[C@@H]1CC(C)C)=O)CC(C)C)=O)CC(=O)O)=O)C)=O)C(C)C)CCC(=O)O)CCCCCCCCCCC(CC)C
Compound: Ymf 1029D
SMILES: O=C1C2=C3C(O[C@@]45C=6C(=C(O)C=CC6O[C@@]3(O4)CC1)[C@@H](O)[C@@H]7[C@H]5O7)=CC=C2
Compound: Asperorydine L
SMILES: O=C1C2=C(NC)C=CC=C2C[C@@H]3C1=C4N(C(=O)C(=C4O)C(=N)C)C3(C)C
Compound: S56-P1
SMILES: S(CC1N(O)C(C(NC(=O)CN)C(=O)O)CC1OC(=O)/C=N/N)CC(NC(=O)C)C(=O)O
Compound: Sonomolide B
SMILES: O=C1O[C@@H]2C[C@H]3[C@H](C(C=C)=CC[C@@H]3[C@@]4([C@@]2([C@@]1([C@@H](O)CC4)C)O)C)C
Compound: 5alpha,8alpha-epidioxy-23-methyl-(22E,24R)-ergosta-6,22-dien-3beta-OL
SMILES: O1O[C@@]23C=C[C@]14C(CC[C@]5(C4CCC5[C@@H](/C=C(/[C@@H](C(C)C)C)\C)C)C)[C@]2(CC[C@@H](C3)O)C
Compound: Collismycin M4
SMILES: S(C1=C(OC)C=C(C2=NC=CC(=C2)C)N=C1C=NO)C
Compound: 6'-dechloroarnamial
SMILES: O=C(O[C@H]1C2=C(C=O)[C@@H](O)[C@@H]3CC(C[C@@H]3[C@@]2(C)C1)(C)C)C4=C(O)C=C(OC)C=C4C
Compound: Asperorydine M
SMILES: O=C1N2C([C@@H]3CC=4C=CC=C5C4[C@@]([C@@H]3[C@H]2C(=C1C(=N)C)O)(O)C(=O)N5C)(C)C
Compound: Acinetodin
SMILES: O=C1NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)O)CC2=CC=C(O)C=C2)CC3=CC=C(O)C=C3)CC(=O)N)CCC(=O)O)C(O)C)C(C)C)CC=4C5=C(C=CC=C5)NC4)C(O)C)CCC(=O)NCC(=O)NCC(NC(C(NCC(N6C(C(NC1C(CC)C)=O)CCC6)=O)=O)CCCCN)=O)CC7=CC=CC=C7
Compound: 7-hydroxyjanthinone
SMILES: O=C1OC2=C(C(O)=CC(=C2)C)C(C3=C1C=CC(=C3OC)O)=O
Compound: Collismycin M6
SMILES: S(C1=C(OC)C=C(C2=NC(=CC=C2)C)N=C1C=NO)C
Compound: Cyclopaldic acid
SMILES: O=C1O[C@H](O)C=2C1=C(OC)C(=C(O)C2C=O)C
Compound: Necpyrone E
SMILES: O=C1O[C@@H]([C@@H](O)C(=C1)OC)[C@@H](O)CCCC
Compound: Klebsidin
SMILES: S(CCC(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C1N(C(=O)C(NC(=O)C(NC(=O)C(NC(=O)C2NC(=O)C(NC(=O)C(NC(=O)C3N(C(=O)CNC(C(NC(C(NC(CNC(CC2)=O)=O)CO)=O)CC(=O)O)=O)CCC3)C(CC)C)C(CC)C)CC4=CC=CC=C4)CC5=CC=CC=C5)CC(=O)N)CCC1)CC(=O)N)C(C)C)C(=O)NC(C(=O)NC(C(=O)NCC(=O)O)CC6=CC=C(O)C=C6)CC=7N=CNC7)C
Compound: Asperorydine A
SMILES: O=C1N[C@H]2C3=CNC4=CC=CC=5C[C@H](C([C@@]1(C2=O)C(=O)C)(C)C)[C@@H]3C54
Compound: Tirandamycin F
SMILES: O=C/1NCC(\C1=C(/O)\C=C\C(=C\[C@H]([C@H]2O[C@]3(O[C@@H](C2)[C@@H](O)[C@H]4[C@@]3(O4)C)C)C)\C)=O
Compound: Delftibactin A
SMILES: O=C1N(O)CCCC1NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)/C(/NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(C(O)C(N)C)C)C(O)C(=O)O)C(O)C)=C/C)CCCN(O)C=O)CO)CCCN=C(N)N
Compound: Seiridin
SMILES: O=C1OCC(=C1C)CCCCC[C@H](O)C
Compound: Qinichelin
SMILES: O=C1N(O)CCC[C@@H]1NC(=O)[C@@H](N)CCCN(O)C(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C2=C(O)C(O)=CC=C2)CO)CCCN)CO)CO
Compound: Asperorydine B
SMILES: O=C1N(C2=C3C(=CC=C2)C[C@@H]4[C@H](C3=C1O)[C@@H]5N(C(=O)C(=C5O)C(=N)C)C4(C)C)C
Compound: Austalide P acid
SMILES: O=C1OCC=2C1=C(OC)C3=C(O[C@]4(CC[C@H]([C@@]([C@H]4C3)(CCC(=O)O)C)C(O)(C)C)C)C2C
Compound: Terreumol C
SMILES: O=C1C2=C(O)C=C(OC)C(=C2CC(=CCC[C@@]3([C@@H]1O3)C)C)O
Compound: Haenamindole
SMILES: O=C1N(O)[C@@H](C(=O)N[C@H]1CC2CCCCC2)C[C@@]3(C4=C(C=CC=C4)N5[C@H]3N[C@H](C6=CC=CC=C6)CC5=O)C
Compound: Pyrenochaetic acid H
SMILES: O=C(O)C1=CC(OC)=C(C(=O)C(=O)CC)C(=C1)C
Compound: Acetyl-qinichelin
SMILES: O=C1N(O)CCC[C@@H]1NC(=O)[C@@H](NC(=O)C)CCCN(O)C(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C2=C(O)C(O)=CC=C2)CO)CCCN)CO)CO
Compound: Asperorydine C
SMILES: O=C1NC(C=2C(=C3C(=O)N(C)C4=C3C(C2)=CC=C4)[C@@H]5[C@](C1)(O5)C)(C)C
Compound: Sequoiatone C
SMILES: O=C(OC)C/1=C2C(=C(OC=C2)C)[C@@](\C1=C\C(=O)[C@H](CCCCCC)C)(O)C
Compound: Agistatin E
SMILES: O=C1[C@@]2(O)[C@]3(O[C@@H](C1)O[C@@H]2[C@H](CC)CC3)O
Compound: Hikiamide A
SMILES: O=C1N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(N[C@@H](C(N[C@@H]1C(C)C)=O)CC(C)C)=O)CC2=CC=CC=C2)CC3=CC=CC=C3)CC(C)C
Compound: Repraesentin C
SMILES: O=C1[C@@]2([C@H](O)C[C@]1([C@H]3C[C@](C(=O)O)(C)C[C@H]3C2)C)C
Compound: Dehydroxy-qinichelin
SMILES: O=C1N(O)CCC[C@@H]1NC(=O)[C@@H](N)CCCNC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C2=C(O)C(O)=CC=C2)CO)CCCN)CO)CO
Compound: Asperorydine D
SMILES: O=C1N2C(C3=CC4=CC=CC5=C4C(=C3[C@@H]2O[C@H](C1)C)C(=O)N5C)(C)C
Compound: (11)-Cytochalasa-6(12),13-diene-1,21-dione-16,18-dimethyl-7-hydroxy-lO-phenyl-(7S*,13E,16S*,18S*)
SMILES: O=C1[C@]23C(=O)N[C@@H]([C@H]2[C@@H](C)C([C@@H]([C@H]3C=CC[C@H](C[C@@H](CC1)C)C)O)=C)CC4=CC=CC=C4
Compound: Colobetaolactone G
SMILES: O=C1OC(C2(O)CCC=3[C@]4([C@]([C@@H]([C@@H](C5OC(=O)C(C)=CC5)C)C[C@H]4OC(=O)C)(C)CCC3C=C2C=C1)C)(C)C
Compound: Hikiamide B
SMILES: O=C1N([C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(N[C@@H](C(N[C@@H]1CC(C)C)=O)CC2=CC=CC=C2)=O)CC3=CC=CC=C3)CC(C)C)C(C)C)C
Compound: Talaroflavone
SMILES: O=C1OC2(C(=CC(C2O)=O)C)C=3C1=C(O)C=C(OC)C3
Compound: Imizoquin A
SMILES: O=C1C(OC)=C(O)C(=O)C2=C1[C@@H]3N(C(=O)[C@@H](N3)CC=4C5=C(C=CC=C5)NC4)C(C2)C(=O)N[C@H](C(=O)O)CC(CO)C
Compound: Lyngbyaloside
SMILES: Br/C=C/C=C/C1OC(=O)C([C@@]2(O[C@H](C(C)C(CC=CC(C1)C)O)C[C@@H](C2)O[C@H]3O[C@@H]([C@@H](OC)[C@@H]([C@@H]3OC)OC)C)O)C
Compound: Asperorydine E
SMILES: O=C1N2C(C3=CC4=CC=CC5=C4C(=C3[C@H]2O[C@H](C1)C)C(=O)N5C)(C)C
Compound: 3,8-dihydroxy-1-propylanthraquinone
SMILES: O=C1C2=C(OC)C=CC=C2C(=O)C3=C1C(=CC(=C3)O)CCC
Compound: Hikiamide C
SMILES: O=C1N([C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(N[C@@H](C(N[C@@H]1CC(C)C)=O)CC=2C3=C(C=CC=C3)NC2)=O)CC4=CC=CC=C4)CC(C)C)C(C)C)C
Compound: Altersolanol B
SMILES: O=C1C2=C(O)C=C(OC)C=C2C(=O)C3=C1C[C@@H](O)[C@](C3)(O)C
Compound: Imizoquin B
SMILES: O=C1C(OC)=C(O)C(=O)C2=C1[C@@H]3N(C(=O)[C@@H](N3)CC=4C5=C(C=CC=C5)NC4)C(C2)C(=O)N[C@H](C(=O)O)CC(CO)CO
Compound: Colobetaolactone A
SMILES: O=C(OC[C@@]12C3=C([C@]4([C@]([C@@H]([C@@H](C(O)C/C=C(\CO)/C)C)CC4)(C)CC3)C)CC[C@H]1C([C@@H](O)CC2)(C)C)C
Compound: Nocarasin A
SMILES: OC1=C(C=CC(=C1)CO)C/C=C(/CCC=C(C)C)\C
Compound: Asperorydine G
SMILES: O=C1N(C(=O)C[C@@H](O)C)C(C)(C)C=2C1=C3C(=O)N(C)C4=C3C(=CC=C4)C2
Compound: Fuscoporianol A
SMILES: O(C([C@H]1[C@H](O)[C@H]([C@@H]2[C@@]3([C@@](C4=C([C@@]5(C(C([C@@H](O)CC5)(C)C)CC4)C)CC3)(C)CC2)C)CC1)(C)C)C
Compound: N(4)-(N-acetylaminopropyl)spermidine
SMILES: O=C(NCCCN(CCCN)CCCCN)C
Compound: Imizoquin C
SMILES: O=C1N2C(C(=O)N[C@H](C(=O)O)CC(CO)CO)CC=3C(O)=C(O)C(=C(C3[C@H]2N[C@H]1CC=4C5=C(C=CC=C5)NC4)O)OC
Compound: methyl aeruginosate B
SMILES: O=C(O[C@H]1C(OC(=O)C)C(C2CCC3C([C@]2(C1)C)=CC[C@@]4([C@@H](C5[C@@H](O[C@@H](C(O)(C)C)CC5)O)CC[C@@]34C)C)(C)C)CC(O)(CC(=O)OC)C
Compound: Phoslactomycin E
SMILES: P(=O)(O[C@H]([C@](O)(C=C[C@@H]1OC(=O)C=C[C@@H]1CC)CCN)C[C@H](O)C=CC=C[C@H]2C[C@@H](OC(=O)C3CCCCC3)CCC2)(O)O
Compound: Fuscoporianol B
SMILES: O(O)C(/C=C/[C@@H](O)[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)C
Compound: Asperorydine H
SMILES: O=C1C2=C(NC)C=CC=C2C[C@@H]3[C@H]1[C@@H]4N(C(=O)C(=C4O)C(=O)C)C3(C)C
Compound: Imizoquin D
SMILES: O=C(N[C@H](C(=O)O)CC(CO)CO)C1N2C(=NC(=C2O)C=C3C4=C(C=CC=C4)N=C3)C=5C(O)=C(OC)C(=C(C5C1)O)O
Compound: Inducamide A
SMILES: ClC1=C(C(=C(O)C=C1)C(=O)N[C@H](C(=O)O)CC=2C3=C(C=C(Cl)C=C3)NC2)C
Compound: 8-demethyl-8-D-glucosyltetracenomycin C
SMILES: O=C1C2=C(O)C=3C(=CC(O[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO)=C(C3C)C(=O)OC)C=C2C(=O)[C@@]5([C@@]1(O)C(=O)C=C(OC)[C@H]5O)O
Compound: Monaphilol A
SMILES: O=C1O[C@]2([C@@H](O)C3=COC(=CC3=CC2=C1C(=O)CCCCCCC)/C=C/C)C
Compound: Fuscoporianol C
SMILES: OC(/C=C/[C@@H](O)[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)C
Compound: Samholide B
SMILES: O=C1O[C@H]([C@H]([C@@H](O)[C@H](CC[C@@H]2O[C@H](C[C@H](C2)OC)C)C)C)C[C@H](O)C[C@H](O)[C@@H]([C@@H](OC)C[C@H]3O[C@@H](C=CC3)C[C@@H](O[C@H]4OC[C@H](OC)[C@H]([C@@H]4OC(=O)[C@H](O)CO)OC)CC=C(C=CC(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@H]5O[C@H](C[C@H](CC=C(C=C1)C)O[C@H]6OC[C@H](OC)[C@H]([C@@H]6OC(=O)[C@H](O)CO)OC)C=CC5)OC)C)O)O)[C@H]([C@@H](O)[C@H](CC[C@@H]7O[C@H](C[C@H](C7)OC)C)C)C)C)C
Compound: Tyrobetaine
SMILES: O=C(O)[C@@H](NC(=O)C(NC(=O)[C@@H](NC(=O)C([N+](C)(C)C)CC1=CC=C(O)C=C1)CC2=CC=C(O)C=C2)C(O)C(C)C)C
Compound: Kolokoside D
SMILES: O=C1OC[C@H](C(C)C)[C@@]2([C@@H]1[C@]3([C@]([C@@H]4C([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)O)(C)C)CC4)C)=CC3)(C)C[C@H]2O)C)C
Compound: 7-methoxy-3-methyl-5-(3-methylbut-2-en-1-yl)-1H-isochromen-6-ol
SMILES: O1C(=CC=2C(=C(O)C(=CC2C1)OC)CC=C(C)C)C
Compound: Inducamide B
SMILES: ClC1=C(C(=C(O)C=C1)C(=O)N[C@H](C(=O)O)CC=2C3=C(C=CC=C3)NC2)C
Compound: Bisacremine E
SMILES: O1C([C@H]2C=C3[C@@H](O)C[C@]([C@H]([C@H]3[C@H]([C@@H]2C1(C)C)C4=C[C@H](O)[C@@](O)(C)C[C@@H]4O)O)(O)C)(C)C
Compound: Chlorotyrobetaine
SMILES: ClC1=C(O)C=CC(=C1)CC([N+](C)(C)C)C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)O)C)C(O)C(C)C)CC2=CC=C(O)C=C2
Compound: Samholide D
SMILES: O=C1O[C@H]([C@H]([C@@H](O)[C@H](CC[C@@H]2O[C@H](C[C@H](C2)OC)C)C)C)C[C@H](O)C[C@H](O)[C@@H]([C@@H](OC)C[C@H]3O[C@@H](C=CC3)C[C@@H](O[C@H]4OC[C@H](OC)[C@H]([C@@H]4O)OC)CC=C(C=CC(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@H]5O[C@H](C[C@H](CC=C(C=C1)C)O[C@H]6OC[C@H](OC)[C@H]([C@@H]6O)OC)C=CC5)OC)C)O)O)[C@H]([C@@H](O)[C@H](CC[C@@H]7O[C@H](C[C@H](C7)OC)C)C)C)C)C
Compound: Citrifelin B
SMILES: O1C2=C3C(=C(C)C(=C2)O)[C@@H]([C@@H](C)O[C@@H]3C[C@@H]1C4=CC(OC)=C(O)C=C4)C
Compound: Inducamide C
SMILES: ClC1=C(C=2C(=O)N[C@H](CC=3C4=C(O)C=C(Cl)C=C4NC3)C(OC2C=C1)=O)C
Compound: Galvaquinone B
SMILES: O=C1C2=C(O)C(=C(C)C(=C2C(=O)C=3C1=C(O)C=CC3)O)C(=O)CCC(C)C
Compound: Bisacremine F
SMILES: O1C([C@@H]2C=C3[C@@H](O)C[C@]([C@H]([C@@H]3[C@@H]([C@H]2C1(C)C)C4=C[C@H](O)[C@@](O)(C)C[C@@H]4O)O)(O)C)(C)C
Compound: Barnesin A
SMILES: O=C(O)/C=C/[C@@H](NC(=O)[C@@H](NC(=O)/C=C/CCCCC)CC1=CC=C(O)C=C1)CCCN=C(N)N
Compound: Drechslerine E
SMILES: O1[C@@H](OC)[C@@H]2[C@@H]3C(=C)[C@]([C@@H]2C1)(CC[C@@H]3C(O)(C)C)C
Compound: GameXPeptide E
SMILES: O=C1N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(N[C@H](C(N[C@@H]1C(C)C)=O)CC(C)C)=O)CC(C)C)CC2=CC=C(N)C=C2)CC(C)C
Compound: Campyrone B
SMILES: O=C1OC(=CC(=C1)OC)[C@@H](NC(=O)C)CC(C)C
Compound: Sch 18640
SMILES: S=C1N[C@@H]2C=3SC=C(N3)[C@H]4N[C@@H](C=5SC=C(N5)C(=O)NC(C(=O)NC(C(=O)N)=C)=C)CC[C@]4(NC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H](NC([C@@H](N[C@H]6[C@@H](C=7N=C(C(O[C@@H]2C)=O)C=C([C@@H](O)C)C7C=C6)O)[C@@H](CC)C)=O)C)=C)C)C=8SC=C(N8)C(=O)N[C@@H]([C@H](O)C)C(N\C(\C9=N[C@@H](C(N[C@H](C%10=NC1=CS%10)[C@@](O)([C@H](O)C)C)=O)CS9)=C/C)=O
Compound: Chrodrimanin D
SMILES: O=C1O[C@@H](CC=2C1=C(O)C=C3O[C@]4([C@@H](O)C[C@@H]5[C@@]([C@@H]4CC23)([C@@H](O)CC(=O)C5(C)C)C)C)C
Compound: Trichorzin MA-2
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(C)C)CO)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)C(NC(=O)C(NC(=O)C)(C)C)CO)C)(C)C)(CC)C)CCC(=O)N)(C)C)CC(C)C)(C)C)CC(C)C)(C)C
Compound: Samholide G
SMILES: O=C1O[C@H]([C@H]([C@@H](O)[C@H](CC[C@@H]2O[C@H](C[C@H](C2)OC)C)C)C)C[C@H](O)C[C@H](O)[C@@H]([C@@H](OC)C[C@H]3O[C@@H](C=CC3)C[C@@H](O[C@H]4OC[C@H](OC)[C@H]([C@@H]4O)OC)CC=C(C=CC(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@H]5O[C@H](C[C@H](CC=C(C=C1)C)O[C@H]6OC[C@H](OC)[C@H]([C@@H]6OC(=O)[C@H](O)CO)OC)C=CC5)OC)C)O)O)[C@H]([C@@H](O)[C@H](CC[C@@H]7O[C@H](C[C@H](C7)OC)C)C)C)C)C
Compound: GameXPeptide F
SMILES: O=C1N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(N[C@H](C(N[C@@H]1CC2=CC=C(N)C=C2)=O)CC(C)C)=O)CC(C)C)CC(C)C)CC(C)C
Compound: (5Z)-Fusarin C
SMILES: O=C1N[C@](O)(CCO)[C@H]2[C@@]1(O2)C(=O)/C(=C/C=C/C(=C\C(=C\C(\C(=O)OC)=C/C)\C)/C)/C
Compound: Oxaleimide C
SMILES: O=C1NC(=O)C=2C1=C(OC(C)C2CCCCC)[C@@H]3[C@@](O)(C(=O)/C=C/C)C[C@H]4[C@H]3[C@H](C[C@@H](C(=O)O)C4)C
Compound: Chrodrimanin G
SMILES: O=C1O[C@@H]([C@H](OC(=O)C)C=2C1=C(O)C=C3O[C@]4([C@@H](O)C[C@@H]5[C@@]([C@@H]4CC23)(CCC(C5(C)C)=O)C)C)C
Compound: Spiromastixone J
SMILES: ClC1=C2OC(=O)C=3C(=C(Cl)C(=C(C3OC2=C(CCC)C(=C1OC)Cl)Cl)O)CCC
Compound: GameXPeptide G
SMILES: O=C1N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(N[C@H](C(N[C@@H]1C(C)C)=O)CC(C)C)=O)CC(C)C)CC2=CC=C(NC)C=C2)CC(C)C
Compound: Periconiasin B
SMILES: O=C1[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C(=C[C@@H]3CC(C)=CC[C@H](C1)O)C)CC(C)C
Compound: Oxaleimide A
SMILES: O=C1NC(=O)[C@H]([C@@H]1C(=O)[C@@H]2[C@@H](C=C[C@H]3[C@H]2[C@H](C[C@H](C3)C(=O)O)C)/C=C/C)[C@H](C=C)CCCCC
Compound: Decarestrictine A2
SMILES: O=C1O[C@@H](C[C@@H]2O[C@@H]2C=C[C@H](C1)O)C
Compound: 4,8-Dimethyl-1,5-dioxacyclooctane-2,6-dione
SMILES: O=C1OC(CC(=O)OC(C1)C)C
Compound: Glucopiericidinol A2
SMILES: O=C1C(OC)=C(OC)NC(=C1C)C=CC(O)(CC=CC(=CC(C(OC2OC(C(O)C(C2O)O)CO)C(=CC)C)C)C)C
Compound: GameXPeptide H
SMILES: O=C1N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(N[C@H](C(N[C@@H]1CC2=CC=C(NC)C=C2)=O)CC(C)C)=O)CC(C)C)CC(C)C)CC(C)C
Compound: Decarestrictine C1
SMILES: O=C1O[C@@H](CC[C@H](O)C=C[C@H](C1)O)C
Compound: Oxaleimide B
SMILES: O=C1NC(=O)[C@H]([C@@H]1C(=O)[C@@H]2[C@@](O)(C(=O)/C=C/C)C[C@H]3[C@H]2[C@H](C[C@@H](C(=O)O)C3)C)[C@H](C=C)CCCCC
Compound: Samholide H
SMILES: O=C1O[C@H]([C@H]([C@@H](O)[C@H](CC[C@@H]2O[C@H](C[C@H](C2)OC)C)C)C)C[C@H](O)C[C@H](O)[C@@H]([C@@H](OC)C[C@H]3O[C@@H](C=CC3)C[C@@H](O[C@H]4OC[C@H](O)[C@H]([C@@H]4O)OC)CC=C(C=CC(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@H]5O[C@H](C[C@H](CC=C(C=C1)C)O[C@H]6OC[C@H](OC)[C@H]([C@@H]6O)OC)C=CC5)OC)C)O)O)[C@H]([C@@H](O)[C@H](CC[C@@H]7O[C@H](C[C@H](C7)OC)C)C)C)C)C
Compound: Penicillenol B1
SMILES: O=C1N(/C(=C\C)/C(=C1C(=O)[C@H](CCCCCC)C)O)C
Compound: Fluvirucin B0
SMILES: O=C1NCCC[C@H]([C@H](OC2OC(C(O)C(C2O)N)C)CCCCCC[C@H]1CC)CC
Compound: Decarestrictine C2
SMILES: O=C1O[C@@H](CC[C@H](O)C=C[C@@H](C1)O)C
Compound: GameXPeptide I
SMILES: O=C1N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(N[C@H](C(N[C@@H]1C(C)C)=O)CC(C)C)=O)CC(C)C)CC2=CC=C(N(C)C)C=C2)CC(C)C
Compound: Oxaleimide D
SMILES: O=C1NC(=O)[C@H]([C@@H]1C(=O)[C@@H]2C(=C[C@@H](O)[C@H]3[C@H]2[C@H](C[C@H](C3)C(=O)O)C)/C=C/C)[C@H](C=C)CCCCC
Compound: 1alpha,10alpha-Epoxy-3alpha-hydroxyeremophil-7(11)-en-12,8beta-olide
SMILES: O=C1O[C@@H]2C[C@]34O[C@H]3C[C@H]([C@@H]([C@]4(CC2=C1CC)C)C)O
Compound: Decarestrictine E
SMILES: O=C1O[C@@H](C[C@@H]2O[C@@H]2[C@@H](CC(C1)=O)OC)C
Compound: (S)-6-(2,9-dihydroxynonyl)-4-hydroxy-3-methyl-2H-pyran-2-one
SMILES: O=C1OC(=CC(=C1C)O)C[C@@H](O)CCCCCCCO