MonarchInit/C3PO huggingface dataset:
Compound: Trichodestruxin A
SMILES: O=C1N([C@H](C(=O)NCCC(=O)O[C@H](CC=C)C(N2[C@H](C(N[C@H](C(N([C@H]1C(C)C)C)=O)C(C)C)=O)[C@H](CC2)C)=O)C)C
Compound: Thalabetaospiramide B1
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[C@H](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: Separacene D
SMILES: O[C@H](/C=C/C=C/C=C/[C@@H](O)[C@H](O)C=C)[C@H](O)/C=C/C
Compound: Moriniafungin C
SMILES: O=C1O[C@]2([C@H](OC)[C@H](O[C@H]([C@H]2O)OC[C@]34[C@@]5(C(C(C)C)=C[C@H]3C[C@]5(C=O)[C@@H]6CC[C@H]([C@H]6C4)C)C(=O)O)C)O[C@H]1CCCC(=O)O
Compound: Emefuran D
SMILES: O=C(O)C[C@@H]1OCC=2C1=C(C=CC2O)CC=C(C)C
Compound: Trichodestruxin B
SMILES: O=C1N([C@H](C(=O)NCCC(=O)O[C@H](C[C@@H](O)CO)C(N2[C@H](C(N[C@H](C(N([C@H]1C(C)C)C)=O)C(C)C)=O)CCC2)=O)C)C
Compound: Gallicynoic acid E
SMILES: O=C(O)CC(O)CCCCC/C=C\C(O)C#CC(O)CCCC
Compound: Phomosine E
SMILES: O=C(OC)C1=C(O)C(=C(O)C(=C1C)OC2=C(C(O)=CC(=C2)C)COCOC)C
Compound: Emefuran A
SMILES: O1[C@@H](C=2C(=CC=C(C2C1)O)CC=C(C)C)C[C@@H](O)[C@H](O)CCCCC
Compound: Trichodestruxin C
SMILES: O=C1N([C@H](C(=O)NCCC(=O)O[C@H](CC(C)C)C(N2[C@H](C(N[C@H](C(N([C@H]1C(C)C)C)=O)C(C)C)=O)[C@H](CC2)C)=O)C)C
Compound: 6-epi-3-anhydroophiobolin B
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(=CC[C@H]3[C@@](O)([C@H](CCC=C(C)C)C)CC[C@@]3(C2)C)C=O
Compound: Moriniafungin D
SMILES: O=C1O[C@]2([C@H](OC)[C@H](O[C@H]([C@H]2O)OC[C@]34[C@@]5(C(C(C)C)=C[C@H]3C[C@]5(C=O)[C@@H]6CC[C@H]([C@H]6C4)C)C(=O)O)C)O[C@H]1CCCC(=O)OC
Compound: Brabetaicicene I
SMILES: O(C[C@]1(O)C2=C[C@@]3(C(=C(C(C)C)CC3)C[C@@H]([C@@H]([C@@H]2CC1)C)O)C)C
Compound: Emefuranone A1
SMILES: O=C1O[C@H](C[C@@H](O)[C@H](O)CCCCC)C=2C1=C(O)C=CC2CC=C(C)C
Compound: Trichodestruxin D
SMILES: O=C1N([C@H](C(=O)N[C@H](C(=O)NCCC(O[C@@H](C(N2[C@H](C(N[C@H]1C(C)C)=O)CCC2)=O)CC(C)C)=O)C)C(C)C)C
Compound: Okilactomycin C
SMILES: O=C1O[C@]23[C@H](C=C(C(=O)O)[C@H](C2)C)CCC[C@@H](C)C[C@H](C=C(C(=C1C3=O)O)C)C
Compound: androstane-3,17-dione
SMILES: C[C@]12CC[C@H]3[C@@H](CCC4CC(=O)CC[C@]34C)[C@@H]1CCC2=O
Compound: Banyaside B
SMILES: S(=O)(=O)(OCC(OC)C(=O)N[C@@H](C(=O)N1[C@@H](C(=O)NCCC2=CCN(C2)C(=N)N)[C@@H]3NC(=O)O[C@@]34C[C@@H](C[C@@H]1[C@@H]4O)O[C@H]5O[C@@H]([C@@H](O)[C@@H]([C@H]5O)O)COC(=O)CCCCC)CC(C)C)O
Compound: Moriniafungin E
SMILES: O=C1O[C@]2([C@H](OC)[C@H](O[C@H]([C@H]2O)OC[C@]34[C@@]5(C(C(C)C)=C[C@H]3C[C@]5(C=O)[C@@H]6CC[C@H]([C@H]6C4)C)C(=O)O)C)O[C@H]1CCCCCCCC(=O)OC
Compound: Emefuranone A2
SMILES: O=C1O[C@@H](C[C@@H](O)[C@H](O)CCCCC)C=2C1=C(O)C=CC2CC=C(C)C
Compound: Farnesylemefuranone D
SMILES: O=C1OCC2=C1C=C(OC)C(=C2O)OC/C=C(/CC/C=C(/CCC=C(C)C)\C)\C
Compound: Nivetetracyclate A
SMILES: O=C1C2=C(O)C=3C(=C(O)C=4CC[C@]([C@@H](C4C3)C(=O)OC)(O)CC)C=C2[C@H](O)CC1
Compound: Memnobotrin A
SMILES: O=C1NCC2=C1C=C(O)C3=C2O[C@@]4([C@@H]([C@@]5([C@H](C([C@@H](OC(=O)C)CC5)(C)C)CC4)C)C3)C
Compound: Moriniafungin F
SMILES: O=C1O[C@]2([C@H](OC)[C@H](O[C@H]([C@H]2O)OC[C@]34[C@@]5(C(C(C)C)=C[C@H]3C[C@]5(C(=O)O)[C@@H]6CC[C@H]([C@H]6C4)C)C(=O)O)C)O[C@H]1CCCCCCCC(=O)O
Compound: Emefuranone AB
SMILES: O=C1O[C@@H](CC(=O)O)C=2C1=C(O)C=CC2CC=C(C)C
Compound: (6r)-16,17-dihydroophiobolin H
SMILES: O1[C@]2(O)[C@H]3[C@H](C[C@]4(CC[C@@H]([C@@H]4CC=C3C1)[C@@H](CCC=C(C)C)C)C)[C@@](C2)(O)C
Compound: Mabetaarilactone B
SMILES: O=C1O[C@@H](C)C2=C1[C@H](O)[C@@H](O)[C@@H](O2)/C=C/C
Compound: Moriniafungin G
SMILES: O=C1O[C@]2([C@H](OC)[C@H](O[C@H]([C@H]2O)OC[C@]34[C@@]5(C(C(C)C)=C[C@H]3C[C@]5(C(=O)O)[C@@H]6CC[C@H]([C@H]6C4)C)C(=O)O)C)O[C@H]1CCCCCCCC(=O)OC
Compound: 19-Hydroxylabda-8(17),13-dien-16,15-olid
SMILES: O=C1OCC=C1CC[C@H]2C(=C)CC[C@@H]3[C@@]2(CCC[C@@]3(CO)C)C
Compound: Emericelloxide
SMILES: O=C(C12OC1C=3C(O)=CC=C(C3C=C2)CC=C(C)C)CCCCC
Compound: (5s,6s)-16,17-dihydroophiobolin H
SMILES: O1[C@@]2(O)[C@@H]3[C@H](C[C@]4(CC[C@@H]([C@@H]4CC=C3C1)[C@@H](CCC=C(C)C)C)C)[C@@](C2)(O)C
Compound: Quinolactacin D1/D2
SMILES: O=C1C2=C(N(C)C3=C1C(=O)N[C@]3(O)CC(C)C)C=CC=C2
Compound: Sordaricin B
SMILES: O=C(O)[C@]12C(=C[C@@H]3[C@]1(C[C@H]4[C@H]([C@@]2(C(=O)O)C3)CC[C@H]4C)CO)C(C)C
Compound: Repraesentin F
SMILES: O=C([C@H]1[C@@]2(O)[C@@](CC2)(C)[C@@H]3[C@H]1C[C@@](CO)(C)C3)C
Compound: Streptanoate
SMILES: O=C(OC(C(=O)N)C(C)C)C(O)C(C)C
Compound: Farnesylemefuranone E
SMILES: O=C1OCC2=C1C=C(OC)C(=C2O)OC/C=C(/CC/C=C(/CCCC(O)(C)C)\C)\C
Compound: Communiol G
SMILES: O1[C@@H](C[C@@H]2[C@H](O)C(CO)=CC2)[C@@H]1CC
Compound: Porosuphenol A
SMILES: O=C(/C(=C/C(=C/[C@@H]([C@@H](O)C)C)/C)/C)[C@H](C(=O)[C@@H](CC1=C(OC)C=C(O)C=C1CC(=O)C)C)C
Compound: Mollisine
SMILES: ClC(Cl)C(=O)C1=C2C(=O)C(=CC(C2=C(O)C=C1C)=O)C
Compound: Maniwamycin C
SMILES: OC(/C=C/[N+]([O-])=NC(C(O)C)C)CCC
Compound: (6r)-16,17,21,21-o-tetrahydroophiobolin G
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(=CC[C@H]3[C@@H]([C@H](CCC=C(C)C)C)CC[C@@]3(C2)C)CO
Compound: MR566A
SMILES: ClC1C([N+]#[C-])=CC(C1O)(O)C(O)C
Compound: Methoxyfuranalcohol
SMILES: O1C=C2[C@@H](O)[C@H]3[C@H](CC(C3)(C)C)[C@](CC2=C1)(OC)C
Compound: Porosuphenol B
SMILES: O=C(/C(=C/C(=C/[C@@H]([C@@H](O)C)C)/C)/C)[C@@H](C(=O)[C@@H](CC1=C(OC)C=C(O)C=C1CC(=O)C)C)C
Compound: Maniwamycin D
SMILES: O[C@H]([C@H](N=[N+]([O-])/C=C/CCCC)C)C
Compound: Farnesylemefuranone F
SMILES: O=C1OCC2=C1C=C(OC)C(=C2O)OC/C=C(/CC/C=C(/CCCC(OC(=O)C)(C)C)\C)\C
Compound: Tuscoron A
SMILES: O=C1/C(/OC(=C1)C)=C/C(C(O)C(C(OC)CCC(O)(/C=C(/C2OC(C(C(=O)O)C)CC(=C2)CC)\C)C)C)C
Compound: Maniwamycin E
SMILES: O[C@@H]([C@H](N=[N+]([O-])/C=C/CCCC)C)C
Compound: Gymnasterone A
SMILES: O=C1C2=C3[C@]4(O)[C@@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)C[C@@H]4C[C@]2(NC(=O)/C=C/C(=C/[C@@H](CCCCCC)C)/C)C=O)(CC[C@@H]3[C@@]5(C1=C[C@@H](O)CC5)C)C
Compound: Porosuphenol C
SMILES: O=C(C(=CC(=CC(C(O)C)C)C)C)C(C(=O)C(CC1=C(O)C=C(O)C=C1CC(=O)C)C)C
Compound: Thiocarboxylic A
SMILES: S1C(=C(C=2O[C@@](/C=C/C=C/CC)(C)C(C2C(=O)OC)=O)C=C1)C
Compound: Hainanic acid B
SMILES: O=C1C2=C(C(=O)C[C@@H]3[C@@]2(CCC(C3(C)C)=O)C)[C@@]4([C@H](O)C[C@@H]([C@]4(C1)C)[C@@H](C[C@H](O)/C=C(/C(=O)O)\C)C)C
Compound: Maniwamycin F
SMILES: O=C(N)C(/C=C/[N+]([O-])=NC(C(O)C)C)CCC
Compound: Pseudacyclin E
SMILES: O=C1N2[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCCC[C@@H](C(N[C@@H]1CC3=CC=CC=C3)=O)NC(=O)[C@@H](NC(=O)C)C(C)C)C(C)C)[C@H](CC)C)CCC2
Compound: Porosuphenol D
SMILES: O=C(C(=CC(=CC(C(O)C)C)C)C)C(C1(OC2=C(C(=CC(=C2)O)CC(=O)C)CC1C)O)C
Compound: Thiocarboxylic B
SMILES: S1C(C(=O)O)=CC(=C1C)C=2O[C@@](/C=C/C=C/CC)(C)C(C2C(=O)OC)=O
Compound: WAP-8294Ax8
SMILES: O=C1OC(CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)N(C(C(=O)NC(C(NC(C(NC(C(NC(C(NC(C(NC(C(NC1C(C)C)=O)CCCN)=O)CC=2C3=C(C=CC=C3)NC2)=O)CC(=O)N)=O)CCC(=O)O)=O)CCCN)=O)CC(C)C)CC4=CC=CC=C4)C)CO)C(O)C(=O)N)CO)CCCC(C)C
Compound: [2,5-dihydroxy-3,6-bis(4-hydroxyphenyl)-4-(3-phenylpropanoyloxy)phenyl] 3-methylcyclopent-3-ene-1-carboxylate
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)[C@@H]5CC(C)=CC5
Compound: Neolymphostinol D
SMILES: O=C(NC=1C=2NC(C(=O)CCO)=CC=3C2C(=NC3)C(C1)=N)CC(C)C
Compound: Acremonpeptide A
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]1CO)=O)CCCN(O)C(=O)C)=O)CCCN(O)C(=O)C)CCCN(O)C(=O)C)CC2=CC=CC=C2)CC(C)C
Compound: Thiocarboxylic C1
SMILES: S1C(=C(C=2O[C@@](/C=C/C=C/[C@H](O)C)(C)C(C2C(=O)OC)=O)C=C1)C
Compound: Rulepidatriol
SMILES: O=C1C=C2[C@]([C@@H]3[C@](CO)(C)[C@@H]3[C@@H]([C@@H]2O)O)(C)[C@@H](C1)C
Compound: [2,5-dihydroxy-4-[(3S)-3-hydroxybutanoyl]oxy-3,6-bis(4-hydroxyphenyl)phenyl] 3-methylcyclopent-3-ene-1-carboxylate
SMILES: O=C(OC1=C(O)C(=C(OC(=O)C[C@@H](O)C)C(=C1C2=CC=C(O)C=C2)O)C3=CC=C(O)C=C3)C4CC(C)=CC4
Compound: Acremonpeptide 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]1CC2=CC=CC=C2)=O)CC(C)C)=O)C)CCCN(O)C(=O)C)CCCN(O)C(=O)C)CCCN(O)C(=O)C
Compound: Cryptosporiopsin A
SMILES: ClC1=C(O)C=C(OC)C2=C1CC(=O)C=CCCC(CC[C@H](OC2=O)C)=O
Compound: Thiocarboxylic C2
SMILES: S1C(=C(C=2O[C@@](/C=C/C=C/[C@@H](O)C)(C)C(C2C(=O)OC)=O)C=C1)C
Compound: (+)-applanatumol H
SMILES: O=C1OC[C@]2([C@@]1(CC[C@H]2O)CC(=O)C3=C(O)C=CC(=C3)O)CO
Compound: [4-[(3S)-3-carboxyoxybutanoyl]oxy-2,5-dihydroxy-3,6-bis(4-hydroxyphenyl)phenyl] 3-methylcyclopent-3-ene-1-carboxylate
SMILES: O=C(O[C@H](CC(=O)OC1=C(O)C(=C(OC(=O)C2CC(C)=CC2)C(=C1C3=CC=C(O)C=C3)O)C4=CC=C(O)C=C4)C)O
Compound: Thiocarboxylic D1
SMILES: S1C(=C(C=2O[C@@](/C=C/CC[C@H](O)C)(C)C(C2C(=O)OC)=O)C=C1)C
Compound: Acremonpeptide C
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]1CC2=CC=CC=C2)=O)CCCN(O)C(=O)C)=O)CCCN(O)C(=O)C)CCCN(O)C(=O)C)CC3=CC=CC=C3)CC(C)C
Compound: Xylapyrone A
SMILES: O=C1OC(C(=O)CCCC[C@@H](O)C)=CC(=C1)OC
Compound: Culicinin D
SMILES: O=C(NC(C(=O)N[C@@H](C(=O)N[C@H](C(=O)NC(C(=O)N[C@H](C(=O)NCCC(=O)NC(CNCCO)C)CC(C)C)(C)C)CC(C)C)CC(CCCCCC)C)(C)C)C(NC(=O)[C@@H](NC(=O)[C@H]1N(C(=O)CCC)CCC1)CC(CC(O)CC(=O)CC)C)(C)C
Compound: Unantimycin A
SMILES: O=C1OC(C(=O)OC(C(NC(=O)C2=CC(O)=CC=C2)C(=O)OC(C(OC(C(C1(C)C)O)CC3=CC=CC=C3)=O)C)C)C(CC)C
Compound: Thiocarboxylic D2
SMILES: S1C(=C(C=2O[C@@](/C=C/CC[C@@H](O)C)(C)C(C2C(=O)OC)=O)C=C1)C
Compound: Acremonpeptide D
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]1CC2=CC=CC=C2)=O)CC(C)C)=O)CC=3C4=C(C=CC=C4)NC3)CCCN(O)C(=O)C)CCCN(O)C(=O)C)CCCN(O)C(=O)C
Compound: (1S,2R)-3-oxo-2-(2Z-pentenyl)cyclopentane-1-octanoic acid methyl ester
SMILES: O=C1[C@@H]([C@@H](CCCCCCCC(=O)OC)CC1)C/C=C\CC
Compound: SB-203207
SMILES: S(=O)(=O)(NC(=O)[C@@H](N)[C@H](CC)C)CC(=O)N[C@]1(C(=O)O)[C@H]2[C@H](C(C(=O)N)=CN(C2)C)C[C@@H]1O
Compound: Aotaphenazine
SMILES: O=C1OC(=O)C(C2=CC=CC=C2)=C3C1=C4NC5=C(C=CC=C5)N=C4C=C3
Compound: Gregatin F1
SMILES: O=C1C(=C(CCC)O[C@@]1(/C=C/CC[C@H](O)C)C)C(=O)OC
Compound: Al(III)-acremonpeptide D
SMILES: [Al]12ON(C(=O)C)CCC[C@@H]3NC([C@H](CCCN(O1)C(=O)C)NC([C@H](CCCN(O2)C(=O)C)NC(=O)[C@@H](NC(=O)[C@@H](NC([C@@H](NC3=O)CC=4C5=C(C=CC=C5)NC4)=O)CC(C)C)CC6=CC=CC=C6)=O)=O
Compound: Ganodermic acid S
SMILES: O=C(O)/C(=C/CC[C@H]([C@@H]1[C@@]2([C@@](C=3C([C@@]4([C@H](C([C@H](OC(=O)C)CC4)(C)C)CC3)C)=CC2)(C)[C@@H](C1)OC(=O)C)C)C)/C
Compound: Helioferin B
SMILES: O=C(NC(C(=O)NC(CN(CCO)C)C)(C)C)C(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1N(C(=O)C(CCCCCC)C)CCC1)CC(CC(O)CC(=O)CC)C)C)(C)C)[C@H](CC)C)[C@H](CC)C)(C)C
Compound: 5,10-dihydrophencomycin
SMILES: O=C(OC)C1=C2NC3=C(C(C(=O)O)=CC=C3)NC2=CC=C1
Compound: Gregatin F2
SMILES: O=C1C(=C(CCC)O[C@@]1(/C=C/CC[C@@H](O)C)C)C(=O)OC
Compound: Mabuniamide
SMILES: O=C(OC)[C@H]1N(C(=O)[C@H](N(C(=O)CNC(=O)[C@@H](NC(=O)[C@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)CCC)C)C)CCC2)C)CC3=CC=CC=C3)CC(C)C)C)C(C)C)C(C)C)C)CC4=CC=CC=C4)CCC1
Compound: Calbistrin H
SMILES: O=C(O[C@@H]1[C@@H]2[C@@](C(=O)C(O)CO)([C@H](C=C[C@H]2C[C@H](C1)CO)C)C)[C@H]([C@@H](O)/C(=C/C=C/[C@H](O)[C@H](O)C)/C)C
Compound: AAL Toxin Te2
SMILES: O=C(O)[C@@H](CC(=O)O[C@@H]([C@@H](O)C[C@H](CCCCCCCC[C@H](O)CNC(=O)C)C)[C@@H](CC)C)CC(=O)O
Compound: Drimentine I
SMILES: O=C1N2[C@@H]3N4C=5C=CC=CC5[C@]3(C[C@H]6[C@]4(CC[C@@H]7[C@@]6(CCCC7(C)C)C)C)C[C@H]2C(=O)N([C@H]1C(C)C)C
Compound: Gregatin G1
SMILES: O=C1C(=C(CCC)O[C@@]1(/C=C/C=C/[C@H](O)C)C)C(=O)OC
Compound: Sparticolin A
SMILES: O=C(O)/C=C/C=C1C2(OC=3C=4C(C=CC3)=CC=CC4O2)C=C[C@@H]1O
Compound: Pseudoxylallemycin C
SMILES: O=C1N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(N[C@H]1CC2=CC=C(OCC=C=C)C=C2)=O)CC(C)C)C)CC3=CC=CC=C3)CC(C)C)C
Compound: Fuzanin A
SMILES: O=C1O[C@H](/C=C/C=C/[C@H](O)C)[C@H]2N1C[C@H](O)C=C2C
Compound: Amethysamide
SMILES: O=C(NC1=C(C(=O)N)C=CC=C1)NCCC2=CC=CC=C2
Compound: Sparticolin B
SMILES: O=C1\C(=C/C=C/C(=O)O)\C2(OC=3C=4C(C=CC3)=CC=CC4O2)C=C1
Compound: Gregatin G2
SMILES: O=C1C(=C(CCC)O[C@@]1(/C=C/C=C/[C@@H](O)C)C)C(=O)OC
Compound: Quinadoline A
SMILES: O=C1N2C(=NC3=C1C=CC=C3)C(NC(C2CC4(O)C5=C(C=CC=C5)N6C4NC(C)(C)C6=O)=O)=C(C)C
Compound: Orcinotriol
SMILES: OC1=CC(O)=CC(=C1)C[C@@H](O)C
Compound: 7beta-aminocephalosporanic acid
SMILES: N12[C@@]([C@@H](C1=O)N)(SCC(=C2C(O)=O)COC(C)=O)[H]
Compound: Amethysione
SMILES: O=C1N(C(=O)C=2C=CC=C(C2N1)OC)CCC3=CC=CC=C3
Compound: Sparticolin C
SMILES: O=C(O)C=CC[C@@H]1C2(OC=3C=4C(C=CC3)=CC=CC4O2)C=C[C@@H]1O
Compound: Svalbardine B
SMILES: O=C1C=2C(=C(C(=O)C3=C(O)C=C(OC)C=C3C(=O)OC)C[C@]14C(=O)C5=C(C=C(OC)C=C5C(=O)OC)OC4)C=C(C)OC2C
Compound: Lentztrehalose
SMILES: O1[C@H](O[C@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2O)O)CO)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)OCC(O)C(O)(C)C
Compound: Tremulene-6,11,12-triol
SMILES: O[C@]1([C@H]2C(=C(CO)[C@H](CC1)CO)CC(C2)(C)C)C
Compound: Coccoquinone A
SMILES: O=C1C2=C(O)C(=C(O)C=C2C(=O)C=3C1=C(O)C=C(O)C3)[C@H](COC(=O)C)CCC(=O)C
Compound: Sparticolin D
SMILES: O=C(O)/C=C/C=C1C2(OC=3C=4C(C=CC3)=CC=CC4O2)[C@@H](O)C[C@@H]1O
Compound: Annularin K
SMILES: O=C1OC(=C(C)C(=C1)OC)C[C@@H](O)C
Compound: Verrucarin L acetate
SMILES: O=C1OC[C@@]23[C@@]4(C5(OC5)[C@H](O[C@@H]2C=C(C)[C@H](C3)OC(=O)C)C[C@H]4OC(=O)C=CC=CC(OCCC(=C1)C)=O)C
Compound: Notoamide R
SMILES: O=C1N2[C@@]3(C(=O)N[C@]14[C@@H](O)C=5C6=C(C7=C(OC(C)(C)C=C7)C=C6)NC5C([C@@H]4C3)(C)C)CCC2
Compound: Sparticolin E
SMILES: O=C(O)C[C@H]1O[C@H]2C=CC3([C@H]2C1)OC=4C=5C(C=CC4)=CC=CC5O3
Compound: Svalbardine A
SMILES: O=C1C2=C(OC(=C1)C)C3=C(C=C(OC)C=C3C(=O)OC)OC2
Compound: Coccoquinone B
SMILES: O=C1C2=C(O)C(=C(O)C=C2C(=O)C=3C1=C(O)C=C(O)C3)C(COC(=O)C)CCC(O)C
Compound: Pyripyropene N
SMILES: O=C1OC(C2=CN=CC=C2)=CC3=C1[C@H](O)[C@@H]4[C@@]5([C@H]([C@@]([C@@H](OC(=O)CC)CC5)(COC(=O)CC)C)CC[C@]4(O3)C)C
Compound: Suillumide
SMILES: O=C(N[C@@H]1[C@H](O)[C@@H](CCCCCCCCCCCC)OC1)[C@H](O)CCCCCCCCCCCCCCC
Compound: Cyclo(dehydroalanyl-N,O-dimethylthreonyl)
SMILES: O=C1N([C@H](C(=O)NC1=C)[C@H](OC)C)C
Compound: Sparticolin F
SMILES: O=C(OC)C[C@H]1O[C@H]2C=CC3([C@H]2C1)OC=4C=5C(C=CC4)=CC=CC5O3
Compound: Penipyranicin A
SMILES: O=C(O)C=1OC=C(C2=CC(OC)=CC(=C2)O)[C@@H](C1)C
Compound: (S)-4-hentriacontyl-dihydrofuran-2-one
SMILES: O=C1O[C@@H](CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)CC1
Compound: 1-ethyl-beta-carboline-3-carboxylic acid
SMILES: O=C(O)C1=NC(=C2NC3=C(C2=C1)C=CC=C3)CC
Compound: Sparticolin G
SMILES: O=C1O[C@]2(C(=O)C=CC2)C3(OC=4C=5C(C=CC4)=CC=CC5O3)C=C1
Compound: Penipyranicin B
SMILES: O=C(O)C1=C(O)C=C(OC)C=C1C2=COC(C(=O)O)=C[C@H]2C
Compound: Subglutinol C
SMILES: O=C1OC(=C(C)C(=C1C[C@@H]2C(=C)CC[C@@H]3[C@@]2(CC[C@H]4[C@]3(C[C@@H](/C=C(/CO)\C)O4)C)C)O)C
Compound: Applanatine E
SMILES: O=C1OCCC2=C1C=C3[C@H](O)[C@@](CO)(C)CC3=C2C
Compound: Ymf 1029B
SMILES: O=C1C2=C(O)C=CC3=C2[C@@]4(OC=5C=CC=C6C5[C@@](O3)([C@H](O)C[C@@H]6O)O4)[C@H]7[C@@H]1O7
Compound: Streptoglutarimide A
SMILES: O=C1NC(=O)CC(C1)CC(=O)C=C2O[C@](CO)(C)C[C@H]2C
Compound: Penipyranicin C
SMILES: O=C(O)C1=C(C(=C(O)C=C1OC)C(=O)O)C2=COC(C(=O)O)=C[C@H]2C
Compound: Subglutinol D
SMILES: O=C1OC(=C(C)C(=C1C[C@@H]2C(=C)CC[C@@H]3[C@@]2(CC[C@H]4[C@]3(C[C@@H](CC(CO)C)O4)C)C)O)C
Compound: 7-Carboxypenicitrinol C
SMILES: O=C(O)C1=C(O)C2=C([C@@H]([C@@H](C)O[C@H]2CC(=O)C)C)C(=C1O)C
Compound: Piericidin C7
SMILES: O=C1C(OC)=C(OC)NC(=C1C)C/C=C(/C/C=C/C(=C/[C@H]([C@@H](O)[C@@]2(OC2/C(=C/C)/C)C)C)/C)\C
Compound: Streptoglutarimide B
SMILES: O=C1NC(=O)CC(C1)CC(=O)C=C2O[C@@](CO)(C)C[C@H]2C
Compound: Isopyrenulin
SMILES: O=C1O[C@@H](OC)C=2C(=CC(=C3C2C1=C(O)C=C3OC)C(=O)O)C
Compound: Psychrophilin I
SMILES: O=C1N2C3=C(C=CC=C3)C(=C2)C[C@H](N)C(=O)N[C@H](C(NC4=C1C=CC=C4)=O)C(C)C
Compound: TLN-05220
SMILES: O=C1N(C(=CC2=C1C(=O)C=3C4=C(O)C5=C(O)C6=C(C(=O)C=CC6=O)C(=C5C(=C4C=CC3C2=O)OC)O)C(CC)C)CC(=O)N7C(C(=O)NC(C7)C(=O)O)C
Compound: 2-O-methylalternariol 4-O-beta-[4-methoxyl-glucopyranoside]
SMILES: O=C1OC2=C(C(=CC(=C2)O)C)C=3C1=C(OC)C=C(OC4C(O)C(O)C(OC)C(C4)CO)C3
Compound: Streptoglutarimide C
SMILES: O=C1NC(=O)CC(C1)CC(=O)C=C2O[C@@](CO)(C)C=C2C
Compound: Asperginol A
SMILES: O=C1OC(=C(C)C(=C1C[C@@H]2C(=C)[C@H](O)C[C@@H]3[C@@]2(CC[C@@H]4[C@@]3(CC[C@H](O)C(O4)(C)C)C)C)O)C
Compound: Actinoquinoline A
SMILES: O=C(N[C@H](CO)CC[C@@H](O)CNC(=O)CC(C)C)C1=NC=2C(=CC=CC2)C=C1O
Compound: Aposphaerin C
SMILES: O=C1C2=C(O[C@@H](C1)/C=C/CCC)C=C(O)C=C2CC(=O)O
Compound: JBIR-28
SMILES: O=C1C=C2[C@]([C@H]([C@H](O)CC2)C)(CO)[C@@H]3[C@]1(O3)C(=C)C
Compound: Streptoglutarimide D
SMILES: O=C1NC(=O)CC(C1)CC=2O[C@@](C[C@@H](CO)C)(C)C(C2)=O
Compound: Asperginol B
SMILES: O=C1OC(=C(C)C(=C1C[C@@H]2C(=C)CC[C@@H]3[C@@]2(CC[C@@H]4[C@@]3(CC[C@H](O)C(O4)(C)C)C)C)O)C
Compound: Actinoquinoline B
SMILES: O=C(N[C@@H]1[C@@H](O[C@@H](CNC(=O)CC(C)C)CC1)O)C2=NC=3C(=CC=CC3)C=C2O
Compound: Butyl lucidenate Q
SMILES: O=C1C2=C([C@@]3([C@@H](O)C[C@@H]([C@]3(C1)C)[C@@H](CCC(=O)OCCCC)C)C)[C@@H](O)CC4[C@@]2(CCC(C4(C)C)=O)C
Compound: Ophiocerin B
SMILES: O1[C@@H](C[C@@H](O)[C@@H](C1)O)C
Compound: Streptoglutarimide E
SMILES: O=C1NC(=O)CC(C1)(O)CC=2O[C@@](C[C@@H](CO)C)(C)C(C2)=O
Compound: 7-chlorofolipastatin
SMILES: ClC1=C(O)C(=C2OC(=O)C3=C(OC2=C1C(=CC)C)C(=C(O)C=C3C(=CC)C)C)C
Compound: Asperaustin A
SMILES: O=C1O[C@]2(C(=C)[C@@]3([C@@]1(O)[C@H](OC3=O)C)[C@]4(CC[C@]5(C(=C4[C@@H]2OC(=O)C)C)C=CC(C5(C)C)=O)C)C
Compound: Gloeophyllin C
SMILES: O=C(O)[C@@]1([C@@H](O)CC[C@]2([C@H]1CCC3=C2C[C@@H](O)[C@]4([C@H]3CC[C@@H]4[C@@H](CCC(=C)C(C)C)C)C)C)C
Compound: (-)-applanatumol E
SMILES: O=C1OC[C@@]2([C@]1(CC[C@@H]2O)CC(=O)C3=C(O)C=CC(=C3)O)C(OC)OC
Compound: Streptoglutarimide F
SMILES: O=C1NC(=O)CC(C1)CC=2O[C@@](C[C@@](O)(CO)C)(C)C(C2)=O
Compound: Iminimycin A
SMILES: [N+]12=C([C@H]3C[C@H]3[C@@H]1/C=C/C=C/C(=C/C)/C)CCCC2
Compound: Asperaustin B
SMILES: O=C1OC([C@@]2(C(=C3[C@]([C@]45C(=O)O[C@H]([C@@]4(O)C([C@@]([C@H]3OC(=O)C)(C)C5=C)=O)C)(C)CC2)C)C=C1)(C)C
Compound: Lansai A
SMILES: O=C1N2[C@@H]3N(C=4C=CC(=CC4[C@]3(C)C[C@H]2C(=O)N5[C@H]1C[C@]6(C=7C=CC=CC7N[C@@H]56)C)C(C=C)(C)C)C
Compound: Streptoglutarimide G
SMILES: O=C1C=C(O[C@H]([C@@H]1C)[C@@H](CO)C)CC2CC(=O)NC(C2)=O
Compound: Gloeophyllol C
SMILES: OC1=C(C(=C(C)C2=C1C(=C)[C@](O)(C)C2)CCO)C
Compound: Lumizinone A
SMILES: O=C1NC(=CN=C1CC(C)C)CC2=CC=C(O)C=C2
Compound: Asperaustin C
SMILES: O=C1OC([C@H]2CC[C@]3([C@H]([C@@]2(C=C1)C)C[C@]4(C(=O)[C@]5([C@]3(C(=O)O[C@@H]5C)C4=C)O)C)C)(C)C
Compound: Xylaroside A
SMILES: O1[C@H](OCC2=C(O)C=CC=C2CCC)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)O
Compound: Streptoglutarimide H
SMILES: O=C1[C@H]([C@H](O)CC2CC(=O)NC(C2)=O)C[C@@H](C)[C@H]([C@@H]1C)O
Compound: Lumizinone B
SMILES: O=C1NC(=CN=C1CC2=CC=CC=C2)CC3=CC=C(O)C=C3
Compound: 4-(furan-3-yl)benzaldehyde
SMILES: O=CC1=CC=C(C2=COC=C2)C=C1
Compound: Solitumine A
SMILES: O=C1C2=C(N[C@@H]([C@H]1CNC(=O)CC[C@H](N)C(=O)O)C(C=C)(C)C)C=CC=C2
Compound: 11-Methyldodecan-2-one
SMILES: O=C(CCCCCCCCC(C)C)C
Compound: Streptoglutarimide I
SMILES: O=C1[C@@](O)(C[C@@H](C)C[C@@H]1[C@H](O)CC2CC(=O)NC(C2)=O)C
Compound: Paraphaeosphaeride D
SMILES: O=C1N(OC)C(=C)C2=C1C(O)C(O)(C)C(O2)CCCCCCC
Compound: Penicillanone
SMILES: O=C(OC)C1=C(C(O)=CC=C1)C(=O)C2=C(O)C=C(CO)C=C2O
Compound: Solitumine B
SMILES: O=C1C2=C(NC(=C1CNC(=O)CC[C@H](N)C(=O)O)C(C=C)(C)C)C=CC=C2
Compound: Cyclohelminthol II
SMILES: ClC1=C(/C=C/C)[C@@H](O)CC1=O
Compound: Streptoglutarimide J
SMILES: O=C1C(=CCC2CC(=O)NC(C2)=O)C[C@@H](C)[C@H]([C@@H]1C)O
Compound: Berkleasmin F
SMILES: O=C1C(=C(CO)C)C[C@@]2([C@H](CC[C@H]([C@]32[C@@H]1O3)OC(=O)[C@@H]([C@H](O)C(=C[C@@H](CO)CCCCCC)C)C)C)C
Compound: Ascosalipyrone
SMILES: O=C1OC(=CC(=C1C)O)C(C(=O)C(CC)C)C
Compound: Solitumidine A
SMILES: O=C(O)[C@@H](N)CCC(=O)NCCC=1C2=C(C=CC=C2)NC1C(C=C)(C)C
Compound: Plicatilisin F
SMILES: O=C1C2=C(C(=O)O)[C@@H](O)CC[C@]2(CC[C@]3([C@@H]1C(=O)[C@H](O)[C@@H]3C(C)C)C)C
Compound: Xylodonin A
SMILES: O=C1OCC2=C1[C@@]3([C@H](C(CCC3)(C)C)[C@H](C2)OC(=O)/C=C/C4=CC=CC=C4)C
Compound: Dihydromyrothecine C
SMILES: O=C1OC[C@]23[C@@]4([C@@]5(O)[C@H](O[C@@H]2[C@@H]([C@](O)(C)CC3)C5)C[C@H]4OC(=O)C=CCC[C@@]67[C@@H](C(=C1)CCO6)O[C@H](O)[C@@H]7O)C
Compound: Lysobactin
SMILES: O=C1O[C@H](C2=CC=CC=C2)[C@H](NC(=O)[C@@H](NC(=O)[C@H](N)CC(C)C)CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(N[C@H](C(NCC(N[C@H](C(N[C@H]1CO)=O)[C@H](O)C(=O)N)=O)=O)[C@@H](O)C)=O)[C@H](CC)C)CCCN=C(N)N)CC(C)C)[C@H](O)C(C)C
Compound: Viscosinamide D
SMILES: O=C1O[C@@H]([C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)C[C@H](O)CCCCCCCCC)CC(C)C)CCC(=O)N)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](CC)C)=O)CO)=O)CC(C)C)=O)CO)CC(C)C)C(C)C)C
Compound: Solitumidine B
SMILES: O=C(O)[C@@H](O)CCC(=O)NCCC=1C2=C(C=CC=C2)NC1C(C=C)(C)C
Compound: 1-hydroxyxylodonin A
SMILES: O=C1OCC2=C1[C@@]3([C@H](C(CC[C@H]3O)(C)C)[C@H](C2)OC(=O)/C=C/C4=CC=CC=C4)C
Compound: 2'-epi-fumiquinazoline D
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@@]4(N5[C@@H]6N(C([C@@H]5C)=O)C7=C([C@]6(C[C@@H]2C(=O)N4)O)C=CC=C7)C
Compound: Preubetaiadin B
SMILES: S1SS[C@]23N([C@@H]4NC=5C=CC=CC5[C@@]4([C@@H]2O)C67C8=C(C=CC=C8)N[C@@H]6N9C(=O)[C@]%10(C(C)C)SS[C@@]9([C@H]7O)C(=O)N%10C)C([C@@](S1)(N(C)C3=O)CO)=O
Compound: ICM0301 B
SMILES: O=C(/C(=C/C=C/[C@@H]1[C@H](/C(=C/C)/C)[C@]2(O[C@H]2[C@H]3[C@H]1C[C@@H]4O[C@@]4(C3)C)C)/C)C
Compound: Solitumidine C
SMILES: O=C1NC=2C=CC=CC2[C@]1(C(C=C)(C)C)CCNC(=O)CC[C@H](N)C(=O)O
Compound: 2'-epi-fumiquinazoline C
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@]4(O[C@@]5(C[C@@H]2C(=O)N4)C6=C(C=CC=C6)N7[C@H]5N[C@@H](C)C7=O)C
Compound: Musacin A
SMILES: O=C(OCC(O)CO)/C=C/C(O)C(O)/C=C/C
Compound: 22-hydroxyxylodonin A
SMILES: O=C1OCC2=C1[C@@]3([C@H](C(CCC3)(C)C)[C@H](C2)OC(=O)/C=C/C4=CC=C(O)C=C4)C
Compound: Platencin SL2
SMILES: O=C(O)[C@]1([C@@H]2[C@]([C@@H](C(=C)CC2)CCC(=O)C)(CCC1)C)C
Compound: Solitumidine D
SMILES: O=C(NC1=C(C(=O)CCNC(=O)CC[C@H](N)C(=O)O)C=CC=C1)C(C=C)(C)C
Compound: Euvesperin A
SMILES: O=C1NC(O)(C(C)C)C2C1(O2)C(=O)C(O)(CCCCCC)C
Compound: Penicitol C
SMILES: O=C1OC2=C([C@@H](OC)CC2)C=3C1=C(O)C=C(C)C3
Compound: Xylodonin B
SMILES: O=C(O[C@H]1C=C2[C@H]([C@H](O)OC2)[C@@]3([C@@H]1C(CCC3)(C)C)C)/C=C/C4=CC=CC=C4
Compound: Neoatroviridin A
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)(C)C)CC(C)C)(C)C)(CC)C)(C)C
Compound: Trichoderolide A
SMILES: O=C(OC1=CC(OC2=CC(OC(=O)C)=CC(=C2)C)=CC(=C1)C)C
Compound: Siomycin C
SMILES: S1C(=NC(=C1)C(=O)NC(C(=O)NC(C(=O)OC)=C)=C)C2=N[C@@H]3C=4N=C(C5NC(=O)C=6N=C([C@@H](NC(=O)[C@H]7N=C(\C(\NC(C(NC(C=8N=C(C3(NC(=O)[C@H](NC(=O)C(NC(=O)C(NC(=O)C(C(C)C)N[C@H]9[C@@H](C=%10N=C(C(O[C@@H]5C)=O)C=C([C@@H](O)C)C%10C=C9)O)=C)=C)C)CC2)SC8)=O)[C@@H](O)C)=O)=C\C)SC7)C(O)([C@@H](O)C)C)SC6)SC4
Compound: Euvesperin B
SMILES: O=C1NC(O)(C(C)C)C2C1(O)C(=O)C(CCCCCC)(C)O2
Compound: 11-O-methyl-12-oxoxylodonin B
SMILES: O=C1O[C@@H](OC)[C@H]2C1=C[C@H](OC(=O)/C=C/C3=CC=CC=C3)[C@H]4C(CCC[C@]24C)(C)C
Compound: VM55597
SMILES: O=C1N([C@]23[C@H](C(C)(C)[C@@]4(C2)C(=O)NC5=C4C=CC6=C5OC=CC(O6)(C)C)C[C@]17N(C(=O)C[C@]7(O)C)C3)C
Compound: Trichodermaerin A
SMILES: OC(C(O)CCC(C1C=CC(C)=CC1)C)(C)C
Compound: JBIR-19
SMILES: P(=O)(OC1C2OC2C(O)C(O)CCCCCCCCC=CCCCC(OC(CCC1)=O)C)(OCCN)O
Compound: 7-Chloroemodin
SMILES: Cc1cc(O)c2C(=O)c3c(O)c(Cl)c(O)cc3C(=O)c2c1
Compound: 22-hydroxyxylodonin B
SMILES: O=C(O[C@H]1C=C2[C@H]([C@H](O)OC2)[C@@]3([C@@H]1C(CCC3)(C)C)C)/C=C/C4=CC=C(O)C=C4
Compound: JBIR-76
SMILES: O=C1C2=C(O)C(OC)=C(O)C=C2[C@@H](OC)C=3C1=C(OC3)CO
Compound: Trichoderolide B
SMILES: O=C(OC1=CC(OC2=CC(OC)=CC(=C2)C)=CC(=C1)C)CC
Compound: F1839-E
SMILES: O=C1N(CC2=C1C=C(O)C3=C2O[C@]4([C@@]5([C@H](C([C@H](O)[C@@H](C5)O)(C)C)CC[C@H]4C)C)C3)CCO
Compound: Xylodonin C
SMILES: O=C(O[C@H]1C=C(C=O)[C@@H](O)[C@@]2([C@@H]1C(CCC2)(C)C)C)/C=C/C3=CC=CC=C3
Compound: JBIR-77
SMILES: O=C1C2=C(O)C(OC)=C(O)C=C2[C@@H](OC)C=3C1=C(OC3)C
Compound: Karnatakafuran B
SMILES: O1C2=C(C(=C(C)C(=C2)O)CC=C(C)C)C3=C1C=C(C)C=C3O
Compound: Trichoderolide C
SMILES: O=C1O[C@H](CC2=CC=CC=C2)C[C@H]1OC(=O)C
Compound: (3R,5E,7R,8R,11R,12S,13R,14S,15S)-5,7,8,11,13,15-Hexamethyl-4,10-dioxo-14-{[3,4,6-trideoxy-3-(dimethylamino)-beta-D-xylo-hexopyranosyl]oxy}-1,9-dioxaspiro[2.13]hexadec-5-en-12-yl 2,6-dideoxy-3-O-methy l-alpha-L-arabino-hexopyranoside
SMILES: O=C1C(=C[C@H]([C@H](OC(=O)[C@H](C)[C@H]([C@@H]([C@H]([C@H](C[C@]12OC2)C)OC3OC(CC(C3O)N(C)C)C)C)OC4OC(C(O)C(C4)OC)C)C)C)C
Compound: Bipolaricin A
SMILES: O=C1C2=C([C@H](O)C[C@H]3[C@]4(O[C@@H](/C=C(/CO)\C)C[C@@H]4C)CC[C@@]3(C[C@@H]2C(=C1)C)C)CO
Compound: Oxysporizoline
SMILES: O=C(O)C1=C(N[C@@H]2N3C4=C(C=CC=C4)[C@@H]5NC6=C([C@H]3N5C7=C2C=CC=C7)C=CC=C6)C=CC=C1
Compound: Atlantinone B
SMILES: O=C1O[C@@H]2C(C)(C)[C@@H]3[C@]1([C@@H]4C=C([C@]5(C(=O)[C@](C([C@]5([C@]4(CC3)C)C(=O)OC)=O)(O)C)C)C)CC2
Compound: Trichoderolide D
SMILES: O=C1O[C@H](CC2=CC=CC=C2)C[C@H]1OC(=O)C3=CC=CC=C3
Compound: Lachnumon
SMILES: Cl/C(=C\C)/C12OC1(Cl)C(=O)C=C(C2O)OC
Compound: Bipolaricin B
SMILES: O=C1C2=C([C@@H](O)C[C@H]3[C@]4(O[C@@H](C=C(CO)C)C[C@@H]4C)CC[C@@]3(C[C@@H]2C(=C1)C)C)CO
Compound: Cladosporinone
SMILES: O=C1O[C@@H](CC=2C1=C(O)C3=C(O)C=C(OC)C(=C3C2)C4=C(OC)C=C(O)C5=C4C=C(CC(O)CC(=O)OC)C(C5=O)=O)CC(=O)OC
Compound: Microdiplanol
SMILES: O=CC1=C(C(OC)=CC=C1)CCO
Compound: Trichoderolide E
SMILES: O=C1O[C@H](CC2=CC=CC=C2)C[C@H]1OC(=O)C3=CC=C(OC)C=C3
Compound: Viticolin C
SMILES: O=C1C(O)=CC(OC)=C2C(=C1)COC2=O
Compound: Bipolaricin C
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(=CC[C@H]3[C@]4(O[C@@H](/C=C(/CO)\C)C[C@@H]4C)CC[C@@]3(C2)C)C=O
Compound: A-503451 A
SMILES: Cl[C@@]([C@@H]1NC=2C=CC(=CC2C1)C(=O)O)(COC)CCC(=C(C)C)C
Compound: WA8242 A2
SMILES: O=C(O[C@H](CC(=O)N)CCCCCCCCCCCC(C)C)[C@@H](NC(=O)C[C@@H](O)CCCCCCCCCCC(C)C)CCCC(=O)O
Compound: Trichoderolide F
SMILES: O=C1O[C@H](CC2=CC=CC=C2)C[C@H]1OC(=O)C3=CC(OC)=C(OC)C=C3
Compound: A-503451 B
SMILES: O=C(O)C1=CC2=C(N[C@H](C2)[C@](O)(COC)CCC(=C(C)C)C)C=C1
Compound: 3a,9a-deoxy-3a-hydroxy-1-dehydroxyarthrinone
SMILES: O=C1C2=C(O)C=C(OC)C=C2[C@@H](O)C3([C@H]1COC3)O
Compound: Bipolaricin D
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(C(=O)O)=CC[C@H]3[C@]4(O[C@@H](C=C(C)C)C[C@@H]4C)CC[C@@]3(C2)C
Compound: Harziandione A
SMILES: O=C1[C@@H]2C([C@]3(CCC(C)=C4[C@]([C@@H]3[C@H]2O)(CC4=O)C)[C@@H](C1)C)(C)C
Compound: Fumiquinone B
SMILES: O=C1C(O)=C(OC)C(=O)C(=C1O)C
Compound: Stereumin M
SMILES: O=C1[C@@]2(O)C(=C)CO[C@@H]3[C@H]2[C@H](CC([C@@H]3C)=O)[C@H](C1)C
Compound: A-503451 D
SMILES: O=C(O)C1=CC2=C(N[C@@](COC)(CCC(=C(C)C)C)[C@@H](C2)O)C=C1
Compound: Bipolaricin E
SMILES: O1[C@]2([C@H]3[C@](C[C@@H]4[C@](O)(CC[C@@H]4C(=CC3)CO)C)(C)CC2)[C@@H](C)C[C@@H]1C=C(C)C
Compound: Cyclonerodiol A
SMILES: O=C(O[C@]1([C@H]([C@H]([C@](OC(=O)C)(CCC=C(C)C)C)CC1)C)C)C
Compound: Phomolactone A
SMILES: ClC1=C(O)C2=C(C(=O)O[C@@H](C2)CCC)C(=C1)O
Compound: Dinemasone C
SMILES: O=C1O[C@@H](C[C@H]2[C@@H]1[C@H](O)[C@H](O)[C@](/C=C/C)(C)O2)C
Compound: Bipolaricin F
SMILES: O=C1C2=C(CC[C@H]3[C@]4(O[C@@H](/C=C(/CO)\C)C[C@@H]4C)CC[C@@]3(C[C@@H]2C(=C1)C)C)CO
Compound: AN483
SMILES: ClC1=C(O)C=C(O)C2=C1[C@H](C=3C=C(OC)C=C(C3C2=O)C)C
Compound: Benwamycin A
SMILES: O[C@H]([C@H](C1=C(C=C(CO)C=C1)/C=C/CO)C)[C@@H]([C@@H](O)C)C
Compound: Laschiatrion
SMILES: O=C1CC2C(=O)C=3[C@H]4[C@]([C@@H]([C@@H](C(=O)[C@@H](OC(=O)C5=CC=CC=C5)C(C(C)C)C)C)CC4)(C)C[C@H](C3[C@@]2(C)CC1)O
Compound: Trisindoline
SMILES: O=C1NC=2C=CC=CC2C1(C=3C4=C(C=CC=C4)NC3)C=5C6=C(C=CC=C6)NC5
Compound: Bipolaricin G
SMILES: O=C1C=C(C)[C@@H]2[C@@H]1C(=CC[C@H]3[C@]4(O[C@@H](C=C(CO)C)C[C@@H]4C)CC[C@@]3(C2)C)C
Compound: Hetiamacin B
SMILES: O=C1OC(C(NC(=O)C(O)C(O)C2NC(NC(C2)=O)(C)C)CC(C)C)CC=3C1=C(O)C=CC3
Compound: Benwamycin B
SMILES: O[C@H]([C@H](C1=C(C=C(C)C=C1)/C=C/CO)C)[C@@H]([C@@H](O)C)C
Compound: Decaturin D
SMILES: O=C1OC(C2=CN=CC=C2)=CC3=C1C[C@@]4(C(=CC[C@H]5[C@]4(CC[C@@H]6[C@@]5(CCC(C6(C)C)=O)C)C)C)O3
Compound: Bipolaricin H
SMILES: O=C1C=C(CO)[C@@H]2[C@@H]1C(=CC[C@H]3[C@]4(O[C@@H](C=C(C)C)C[C@@H]4C)CC[C@@]3(C2)C)C
Compound: Caripyrin
SMILES: O=C(OC)C1=NC=C(C2OC2C)C=C1
Compound: Hetiamacin C
SMILES: O=C1OC(C(NC(=O)C(O)C(O)C2NC(NC(C2)=O)C)CC(C)C)CC=3C1=C(O)C=CC3
Compound: Benwamycin C
SMILES: O=C(OC1=CC(=C([C@@H]([C@@H](O)[C@@H](C(=O)C)C)C)C=C1)/C=C/CO)C
Compound: Palmitoylputrescine
SMILES: O=C(NCCCCN)CCCCCCCCCCCCCCC
Compound: Beticolin 3
SMILES: ClC1=C(O)C=2C(O)=C3C(=O)CC[C@H]([C@]3(C(=O)OC)OC2C4=C1C[C@@]56C(=O)C7=C(C(O)=CC=C7O)C(=C5C([C@@H]4C8(OC68)CO)=O)O)O
Compound: Bipolaricin I
SMILES: O=C1C2=C(C(=O)O)[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
Compound: Hetiamacin D
SMILES: O=C1OC(C(NC(=O)C(O)C(O)C2NC(NC(C2)=O)CC)CC(C)C)CC=3C1=C(O)C=CC3
Compound: 3,9-dimethyl-8-(3-methylbut-2-enyl)dibenzouran-1,7-diol
SMILES: O1C2=C(C(=C(CC=C(C)C)C(=C2)O)C)C3=C1C=C(C)C=C3O
Compound: Benwamycin D
SMILES: O=C(O[C@H]([C@H](C1=C(C=C(CO)C=C1)/C=C/CO)C)[C@@H](C(=O)C)C)CC
Compound: Trivirensol A
SMILES: O=C1OCC(C(=O)O)=C[C@H]2[C@H]1[C@@](O)(CC[C@@H]2C(C)C)COC(=O)/C(=C/[C@H]3[C@H](C(=O)O)[C@@](O)(CC[C@@H]3C(C)C)COC(=O)/C(=C/[C@H]4C=5C(=O)OCC5CC[C@@H]4C(C)C)/CO)/CO
Compound: [(4S,5S)-3-ormyl-4-hydroxy-4,5,6,7-tetrahydro-1H-indol-5-yl] acetate
SMILES: O=C(O[C@@H]1[C@@H](O)C=2C(=CNC2CC1)C=O)C
Compound: Aureosurfactin
SMILES: O=C(O[C@@H](C[C@@H](O)CC(=O)OC)CCCCC)C[C@H](O)C[C@H](O)CCCCC
Compound: methyl 4-hydroxy-3-(3-methylbutanoyl)benzoate
SMILES: O=C(OC)C1=CC(=C(O)C=C1)C(=O)CC(C)C
Compound: Benwamycin E
SMILES: O=C(O)/C=C/C1=C(C=CC(=C1)C)[C@@H]([C@@H](O)[C@@H](C(=O)C)C)C
Compound: Trivirensol B
SMILES: O=C1OCC(C(=O)OC[C@@]2(O)[C@H]3C(=O)OCC(=C[C@@H]3[C@@H](C(C)C)CC2)C(=O)O)=C[C@H]4[C@H]1[C@@](O)(CC[C@@H]4C(C)C)COC(=O)/C(=C/[C@H]5C=6C(=O)OCC6CC[C@@H]5C(C)C)/CO
Compound: 3-deoxyaureosurfactin
SMILES: O=C(O[C@@H](CCCC(=O)OC)CCCCC)C[C@H](O)C[C@H](O)CCCCC
Compound: Ent-paeciloketal A
SMILES: O=C(C1=C2C(O[C@@]3(OCC4=C3C=CC=C4O)C(=C2)CCCCCCC)=CC=C1)CCCCCCCC
Compound: Acromelic acid B
SMILES: O=C1NC(=C([C@@H]2[C@@H]([C@@H](C(=O)O)NC2)CC(=O)O)C=C1)C(=O)O
Compound: Benwamycin F
SMILES: O=C1C=C(O[C@@H]([C@@H]1C)[C@H](C2=C(C=C(C)C=C2)/C=C/CO)C)CC
Compound: Trivirensol C
SMILES: O=C1OCC(C(=O)OC[C@@]2(O)[C@H]3C(=O)OCC(=C[C@@H]3[C@@H](C(C)C)CC2)C(=O)O)=C[C@H]4[C@H]1[C@@](O)(CC[C@@H]4C(C)C)COC(=O)/C(=C/[C@@H]5[C@@H](C(C)C)CC[C@@]6([C@H]5C(=O)OC6)O)/CO
Compound: Albaflavenoid
SMILES: O=C(O)C1=C2[C@@]3([C@@H](C)CC2)C[C@@H](C1(C)C)CC3
Compound: Fomitopsin C
SMILES: O=C1O[C@]2(O[C@H]3[C@]4([C@](C=5CC[C@@H]6[C@@](C5C3)(CC[C@H](C6(C)C)OC(=O)CC(=O)O)C)(CC[C@@H]4[C@@H](C2)C)C)C)[C@@H]([C@H]1C)C
Compound: Indoxamycin C
SMILES: O=C(O)/C=C/[C@@]1(C=C([C@@H]2O[C@@H]([C@]3([C@@]2([C@@H]1C(=C3)C)C)C)/C(=C\C)/C)CO)C
Compound: Benwamycin G
SMILES: O=C1C=C(O[C@@H]([C@@H]1C)[C@H](C2=C(C=C(CO)C=C2)/C=C/CO)C)CC
Compound: Trivirensol D
SMILES: O=C1OCC(C(=O)OC[C@@]2(O)[C@H]3C(=O)OCC(=C[C@@H]3[C@@H](C(C)C)CC2)C(=O)O)=C[C@H]4[C@H]1[C@@](O)(CC[C@@H]4C(C)C)COC(=O)/C(=C/[C@H]5C=C(CC[C@@H]5C(C)C)CO)/CO
Compound: Sagamilactam
SMILES: O=C1NC(/C=C/C)CC=CC=CC=C[C@H](O)CC=CC=C[C@H]2[C@H](C=CC=CC=CC=C1C)C=C[C@@H]3CC(O)C[C@@H]([C@@H]23)O
Compound: Desotamide E
SMILES: O=C1N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(N[C@@H](C(N[C@H]1[C@@H](CC)C)=O)C(C)C)=O)CC(C)C)CC=2C3=C(C=CC=C3)NC2)CC(=O)N
Compound: Pompanopeptin A
SMILES: BrC1=C(OC)C=CC(=C1)C[C@@H]2N(C(=O)[C@@H](N3C(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC([C@H]([C@H](OC([C@@H](NC2=O)C(C)C)=O)C)NC(=O)[C@@H](NC(=O)CCC)CCS(=O)C)=O)CC[C@H]3O)[C@H](CC)C)C
Compound: 1,9,17-triazapentacyclo[14.8.0.02,7.010,15.018,23]tetracosa-2,4,6,10,12,14,16,18,20,22-decaene-8,24-dione
SMILES: O=C1NC2=C(C3=NC=4C=CC=CC4C(N3C5=C1C=CC=C5)=O)C=CC=C2
Compound: Hangtaimycin
SMILES: O=C/1N([C@@H](C(=O)N(\C1=C/C)C(=O)C(NC(=O)C(NC(=O)/C=C\C=C\CCCC2=CC(=O)OC(C2)C(O)NC(=O)C(=CC(NC(=O)/C=C\C=C\C)C)C)=C)C(OC)C)CC=3C4=C(C=CC=C4)NC3)C
Compound: Trivirensol E
SMILES: O=C1OCC(C(=O)O[C@@]23[C@@H](C(=O)OC2)[C@H](/C=C(/C(=O)O)\CO)[C@@H](C(C)C)CC3)=C[C@H]4[C@H]1[C@@](O)(CC[C@@H]4C(C)C)COC(=O)/C(=C/[C@H]5C=C(CC[C@@H]5C(C)C)CO)/CO
Compound: Aurachin F
SMILES: O1C2=C(C=3C(=CC=CC3)[N+](=C2C)[O-])C=C[C@@]1(CCC=C(CCC=C(C)C)C)C
Compound: Coumabiocin D
SMILES: O=C1OC2=C(C=CC(=C2C)O[C@@H]3OC([C@H](OC)[C@H]([C@H]3O)OC(=O)N)(C)C)C(=C1NC(=O)C4=CC5=C(OC(C)(C)C(C5)O)C=C4)O
Compound: 7-(1,4-dihydroxy-5-methoxy-8-oxo-6,7-dihydro-5H-naphthalen-2-yl)-5,8-dihydroxy-4-methoxy-3,4-dihydro-2H-naphthalen-1-one
SMILES: O=C1C2=C(O)C(C3=C(O)C4=C(C(OC)CCC4=O)C(=C3)O)=CC(=C2C(OC)CC1)O
Compound: Demethyl-L-681,217
SMILES: O=C(O)/C=C/C=C/C=C/[C@H]1O[C@@H]([C@@H]([C@H](OC)/C(=C/C=C/CNC(=O)[C@H]([C@]2(O[C@@H](/C=C/C=C\C)C(O)(C)[C@H](C2)O)O)C)/C)C)C[C@H]1O
Compound: Trivirensol F
SMILES: O=C1OCC(C(=O)O)=C[C@H]2[C@H]1[C@@](O)(CC[C@@H]2C(C)C)COC(=O)/C(=C/[C@@H]3[C@@H](C(C)C)CC[C@@]4([C@H]3C(=O)OC4)OC(=O)/C(=C/[C@H]5C=C(CC[C@@H]5C(C)C)CO)/CO)/CO
Compound: Dactylocycline A
SMILES: ClC1=C(OC)C=C(O)C2=C1[C@](O[C@@H]3O[C@H]([C@H](OC)[C@](C3)(NO)C)C)([C@H]4C[C@@]5(O)[C@H](N(C)C)C(=O)C(=C([C@]5(C(C4=C2O)=O)O)O)C(=O)N)C
Compound: Talaroconvolutin D
SMILES: O=C1NC2(OC(C)(C)OC2C1C(=O)[C@H]3[C@H](C(=C[C@@]4([C@@H]3CC[C@@H](C4)C)C)C)/C(=C/C(CC)C)/C)CC5=CC=C(O)C=C5
Compound: 3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-1,8-dihydroxy-6-methylanthracene-9,10-dione
SMILES: O=C1C2=C(O)C=C(O[C@H]3O[C@H](CO)[C@H]([C@H]3O)O)C=C2C(=O)C=4C1=C(O)C=C(C)C4
Compound: Ogipeptin A
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](O)CN)C(N[C@H](C(NC[C@H]([C@@H](C(NC1=CC)=O)NC(=O)CCCCCCCCC)O)=O)[C@@H](O)CN)=O)CCCN=C(N)N)CC(C)C)CCN
Compound: Melithiazol F
SMILES: S1C(=NC(=C1)/C=C/C(OC)C(/C(/OC)=C\C(=O)OC)C)C=2N=C(CC3=CC=CC=C3)SC2
Compound: Trivirensol G
SMILES: O=C1OC[C@]2([C@@H]1[C@H](/C=C(/C(=O)O)\CO)[C@@H](C(C)C)CC2)OC(=O)/C(=C/[C@H]3[C@H](C(=O)O)[C@@](O)(CC[C@@H]3C(C)C)COC(=O)/C(=C/[C@@H]4[C@@H](C(C)C)CC[C@@]5([C@H]4C(=O)OC5)O)/CO)/CO
Compound: Isochromophilone XIII
SMILES: ClC1=C2C(C(=O)[C@@](C1=O)(O)C)=CN(CCO)C(=C2)/C=C/[C@H](CC)C
Compound: Ogipeptin B
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](O)CN)C(N[C@H](C(NC[C@H]([C@@H](C(NC1=CC)=O)NC(=O)CCC/C=C\CCCCCC)O)=O)[C@@H](O)CN)=O)CCCN=C(N)N)CC(C)C)CCN
Compound: 3-hydroxy-1,9,17-triazapentacyclo[14.8.0.02,7.010,15.018,23]tetracosa-2(7),3,5,10,12,14,16,18,20,22-decaene-8,24-dione
SMILES: O=C1NC2=C(C3=NC=4C=CC=CC4C(N3C5=C1C=CC=C5O)=O)C=CC=C2
Compound: Alternatone A
SMILES: O=C1C2=C(O)C=CC=C2[C@H]3[C@@H]([C@@H]1[C@@H]4[C@H]3C5=C(C(O)=CC=C5)C(C4)=O)O
Compound: Penicitrinol K
SMILES: O=C(O)C1=C2O[C@](O)(C[C@H]3C2=C([C@@H]([C@@H](C)O3)C)C(=C1O)C)C
Compound: TMC-120-A
SMILES: O=C1C2=C(C=3C(=CC(C)=NC3)C=C2)O[C@H]1C(C)C
Compound: Ogipeptin C
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](O)CN)C(N[C@H](C(NC[C@H]([C@@H](C(NC1=CC)=O)NC(=O)CCCCCCCCCCC)O)=O)[C@@H](O)CN)=O)CCCN=C(N)N)CC(C)C)CCN
Compound: Chrysophanol O-3'-acetyl-alpha-D-ribofuranoside
SMILES: O=C1C2=C(O[C@H]3O[C@H](CO)[C@H]([C@H]3O)OC(=O)C)C=CC=C2C(=O)C=4C1=C(O)C=C(C)C4
Compound: Luminacin E3
SMILES: O=C(C1=C(O)C(=C(O)C(=C1)C(OC)C(C)C)C=O)C(C2O[C@@H](O)C3(O[C@H]3CC)[C@@H](C2)O)CCCC
Compound: Plantaricin A
SMILES: S(CCC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(N)CC1=CC=C(O)C=C1)CO)CC(C)C)CCC(=O)N)C(=O)NCC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C=O)C(CC)C)C)C(O)C)C)C
Compound: 4-isoprenylravenelin
SMILES: O=C1C2=C(OC3=C1C(O)=CC=C3CC=C(C)C)C(O)=C(C)C=C2O
Compound: Ogipeptin D
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](O)CN)C(N[C@H](C(NC[C@H]([C@@H](C(NC1=CC)=O)NC(=O)CCCCC/C=C\CCCCCC)O)=O)[C@@H](O)CN)=O)CCCN=C(N)N)CC(C)C)CCN
Compound: N-[(3S,6S,7R,10S,15R)-15-benzyl-10-[(2S)-butan-2-yl]-3,7,13,13-tetramethyl-2,5,9,12,14-pentaoxo-1,4,8,11-tetraoxacyclopentadec-6-yl]benzamide
SMILES: O=C1O[C@H](C(=O)O[C@@H]([C@H](NC(=O)C2=CC=CC=C2)C(=O)O[C@H](C(O[C@@H](C(C1(C)C)=O)CC3=CC=CC=C3)=O)C)C)[C@H](CC)C
Compound: Asperchalasine H
SMILES: O=C1[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C(=C[C@@H]3C=C(CC[C@H](C([C@H]4[C@H]1[C@H]5O[C@@H]4C=6C5=C(C(O)=C(O)C6O)C)=O)O)C)C)CC(C)C
Compound: Phaeosphaerin D
SMILES: O=C1C=2C=3C(=C4C5=C(C(O)=C(C6=C5C3[C@@]7([C@](O)(C)[C@]6(O[C@H](C7)C)O)[C@@H](C2O)OC)OC)C(=O)C=C4OC)C(=C1)OC
Compound: [(2R,3R,4R,5R)-3,4-diacetyloxy-5-(4,5-dihydroxy-7-methyl-9,10-dioxoanthracen-2-yl)oxyoxolan-2-yl]methyl acetate
SMILES: O=C1C2=C(O)C=C(O[C@H]3O[C@H](COC(=O)C)[C@H]([C@H]3OC(=O)C)OC(=O)C)C=C2C(=O)C=4C1=C(O)C=C(C)C4
Compound: (2S)-2-[[(2R)-2-[[(2S)-3-carboxy-2-[[(2S)-2-[[(2R)-2-[[(3S)-3-[[(2S)-4-carboxy-2-[(3-hydroxy-11-methyldodecanoyl)amino]butanoyl]amino]-5-methylhexanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid
SMILES: O=C(O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)CC(O)CCCCCCCC(C)C)CCC(=O)O)CC(C)C)CC(C)C)C(C)C)CC(=O)O)CC(C)C)CC(C)C
Compound: Spectomycin B1
SMILES: O=C1C2=C(O)C3=C(O)C(C4=C(O)C5=C(O)C6=C(C(C(OC)=CC(=O)O)C(O)(C)CC6=O)C=C5C=C4)=CC=C3C=C2C(C(OC)=CC(=O)O)C(C1)(O)C
Compound: Flavipesine B
SMILES: O=C1N[C@@H](CC(C)C)[C@H]2[C@@]13[C@]4(O[C@]5(CCC[C@]([C@@H]5[C@H]3C=C(CO)[C@H]2C)(O)C)CC4)O
Compound: Maltacine C1a
SMILES: O=C1OCC(O)CC(NC(=O)C(NC(=O)C(NC(=O)[C@H]2NCCC2)CCC(=O)N)CC3=CC=C(O)C=C3)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(NC(C(NC(C(NC(C(NC1C(CC)C)=O)CC4=CC=C(O)C=C4)=O)C)=O)CCCN)=O)CC5=CC=C(O)C=C5)C(O)C)CCC(=O)O)C(C)C
Compound: [(2R,3R,4R,5R)-4-acetyloxy-5-(4,5-dihydroxy-7-methyl-9,10-dioxoanthracen-2-yl)oxy-2-(hydroxymethyl)oxolan-3-yl] acetate
SMILES: O=C1C2=C(O)C=C(O[C@H]3O[C@H](CO)[C@H]([C@H]3OC(=O)C)OC(=O)C)C=C2C(=O)C=4C1=C(O)C=C(C)C4
Compound: (2S)-2-[[(2R)-2-[[(2S)-3-carboxy-2-[[(2S)-2-[[(2R)-2-[[(3S)-3-[[(2S)-4-carboxy-2-[(3-hydroxy-11-methyltridecanoyl)amino]butanoyl]amino]-5-methylhexanoyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid
SMILES: O=C(O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)CC(O)CCCCCCCC(CC)C)CCC(=O)O)CC(C)C)CC(C)C)C(C)C)CC(=O)O)CC(C)C)CC(C)C
Compound: Concrescenin B
SMILES: O=C(OC1=C(OC(=O)C)C(=C(OC(=O)C2=CC=CC=C2)C(=C1C3=CC=C(O)C=C3)OC(=O)C)C4=CC=C(O)C=C4)C5=CC=CC=C5
Compound: Flavipesine A
SMILES: O=C1N[C@@H](CC(C)C)[C@H]2[C@@]13[C@]4(O[C@]5([C@H](O)CCC([C@@H]5[C@H]3C=C(C)[C@H]2C)=C)CC4)O
Compound: Antcamphorol J
SMILES: O=C1C2=C([C@H](O)C[C@@H]3[C@@]2(CCC([C@H]3C)=O)C)[C@@H]4CC[C@@H]([C@]4(C1)C)[C@@H](CCC(=C)C(C)C)C
Compound: 3-amino-4,5,6-trihydroxy-2-methoxy-5-methyl-2-cyclohexen-1-one
SMILES: O=C1C(OC)=C(N)[C@@H](O)[C@]([C@H]1O)(O)C
Compound: RK-144171
SMILES: O=C1OC2=C(O[C@@H]3O[C@H]([C@H](O)[C@H]([C@H]3O)O)C)C=CC=C2C(N1)=O
Compound: 10-Hydroxy-trans-paspalic acid Amide
SMILES: O=C(N)C1=C[C@]2(O)C3=C4C(NC=C4C[C@H]2N(C1)C)=CC=C3
Compound: Asperchalasine G
SMILES: O=C1[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C(=C[C@@H]3C=C(CC[C@H](C([C@H]4[C@H]1[C@@H]5O[C@H]4C=6C5=C(O)C(O)=C(O)C6C)=O)O)C)C)CC(C)C
Compound: Nobilamide H
SMILES: O=C/1O[C@@H]([C@@H](NC(=O)[C@@H](N[C@@H](C(=O)C)C)CC2=CC=CC=C2)C(=O)N[C@@H](C(C)C)C(N[C@H](C(N\C1=C/C)=O)C)=O)C
Compound: Antcamphorol K
SMILES: O=C1C2=C([C@]3(O)CC[C@@H]([C@]3(C1)C)[C@@H](CCC(=C)C(C)C)C)CC[C@@H]4[C@@]2(CCC([C@H]4C)=O)C
Compound: Xantholipin B
SMILES: ClC1=C(OC)C=2OC3=C4OCO[C@H]5C4=C(C6=C(O)C=7C(=O)NC(C)=CC7C(=C6C5)O)C(=C3C(C2C=C1)=O)O
Compound: BSM3
SMILES: O=C1C2=C(O[C@@](C1)(O)C)C=CC=C2CC(=O)O
Compound: Asperchalasine F
SMILES: O=C1[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C(=C[C@@H]3C=C(CC[C@H](C([C@H]4[C@H]1[C@@H]5O[C@H]4C=6C5=C(C(O)=C(O)C6O)C)=O)O)C)C)CC(C)C
Compound: Antcamphorol A
SMILES: O1[C@@](C(C)C)(CC[C@@H](C1)[C@@H]2[C@@]3(C(C4=C([C@@]5([C@H](C([C@@H](O)CC5)(C)C)CC4)C)CC3)=C(C2)C)C)CO
Compound: Indolyl-3-ethanol acetate
SMILES: O=C(OCCC=1C2=C(C=CC=C2)NC1)C
Compound: Allocyclinone A
SMILES: ClC1=C(OC)C2=C3C(=O)C4=C(C(O)=C5[C@](OC)(C)OC(C5=C4O)=O)C(C3=CC=C2C=C1C(Cl)(Cl)Cl)=O
Compound: Cytochalasin K
SMILES: O=C1C=CC(=O)[C@H](OC(=O)C)C(=C[C@H](CC=C[C@@H]2[C@@]13C(=O)N[C@H]([C@@H]3[C@H](C)[C@@]4([C@H]2O4)C)CC5=CC=CC=C5)C)C
Compound: Resorcinoside A
SMILES: O1[C@H](O[C@@H]([C@H](CC)C)CCCCCCC/C=C/C=C/CCC2=CC(O)=CC(=C2)O)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)O
Compound: Antcamphorol B
SMILES: O=C1C2=C([C@@H](O)C[C@@H]3[C@@]2(CC[C@H]([C@@]3(O)C)O)C)[C@@H]4CC[C@@H]([C@]4(C1)C)[C@@H](CC/C(=C\C)/CO)C
Compound: Allocyclinone B
SMILES: ClC1=C(OC)C2=C3C(=O)C4=C(C(O)=C5[C@](OC)(C)OC(C5=C4O)=O)C(C3=CC=C2C=C1C)=O
Compound: Verticillin D
SMILES: S1S[C@@]23N([C@H]4NC=5C=CC=CC5C4([C@@H]2O)[C@@]67C8=C(C=CC=C8)N[C@@H]6N9C(=O)[C@]%10(C(O)C)SS[C@@]9([C@H]7O)C(=O)N%10C)C([C@]1(N(C)C3=O)C(O)C)=O
Compound: 1-hydroxy-2,6,8-trimethoxy-9,10-anthraquinone
SMILES: O=C1C2=C(O)C(OC)=CC=C2C(=O)C=3C1=C(OC)C=C(OC)C3
Compound: Resorcinoside B
SMILES: O=C1OC(=CC(=C1CC2=C(O)C=C(O)C=C2CC/C=C/C=C/CCCCCCC[C@@H](O[C@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)O)CO)[C@H](CC)C)O)C
Compound: Antcamphorol C
SMILES: O=C1C2=C([C@@H](O)C[C@@H]3[C@@]2(CC[C@H]([C@@]3(O)C)O)C)[C@@H]4CC[C@@H]([C@]4(C1)C)[C@@H](CC/C(=C/C)/CO)C
Compound: Ascherxanthone A
SMILES: O=C1C2=C(O)C(C3=C(O)C=4C(=O)C5=CC[C@@H](OC)[C@@H]([C@@]5(C)OC4C=C3C)O)=C(C)C=C2O[C@]6(C1=CC[C@@H](OC)[C@@H]6O)C
Compound: Paecilomycone C
SMILES: O=C1C2=C(O)C(O)=C(N)C=3C2=C(C(OC)=CC3O)C(=C1)C
Compound: Allocyclinone C
SMILES: ClC1=C(OC)C2=C3C(=O)C4=C(C(O)=C5[C@](OC)(C)OC(C5=C4O)=O)C(C3=CC=C2C=C1CCl)=O
Compound: Nectriatide
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(NC2=C1C=CC=C2)=O)CC3=CC=C(O)C=C3)C)C(C)C)C
Compound: Antcamphorol D
SMILES: O=C1C2=C([C@@H](O)C[C@@H]3[C@@]2(CC[C@H]([C@@H]3O)O)C)[C@@H]4CC[C@@H]([C@]4(C1)C)[C@@H](CCC(=C)[C@H](C(=O)O)C)C
Compound: Carbamidocyclophane D
SMILES: ClCCCCC1C2=C(O)C=C([C@H](OC(=O)N)[C@H](CCCCC(CCCC)C3=C(C=C([C@@H]([C@H](CCCC1)C)OC(=O)N)C=C3O)O)C)C=C2O
Compound: Aspergiloid H
SMILES: O=C1C2=C(C=3C=CC(=C4C3[C@@]1(OC[C@H]4OC)O)C)CCCC2(C)C
Compound: Allocyclinone D
SMILES: ClC1=C(OC)C2=C3C(=O)C4=C(C(O)=C5[C@](OC)(C)OC(C5=C4O)=O)C(C3=CC=C2C=C1C(Cl)Cl)=O
Compound: Eutypellacytosporin B
SMILES: O=C1O[C@@]2(O[C@@H](OCC3=C(/C=C/CCCCC)[C@@H](O)[C@H]4[C@@]5([C@H]3OC([C@@H](O)C5)(C)C)O4)[C@]6(C2)[C@@H]7C(=C)[C@@H](OC(=O)C([C@@H](O)C)(C)C)C[C@H]6C7)C[C@@H]1C
Compound: Antcamphorol E
SMILES: O=C1C2=C([C@@H](O)C[C@@H]3[C@@]2(CC[C@H]([C@@H]3O)O)C)[C@@H]4CC[C@@H]([C@]4(C1)C)[C@@H](CCC(=C)[C@@H](C(=O)O)C)C
Compound: Ampelomin D
SMILES: O[C@H]1[C@@H](O)C[C@H](C)[C@@H](C1)O
Compound: Eutypellacytosporin A
SMILES: O=C1O[C@@]2(O[C@H](OCC3=C(/C=C/CCCCC)[C@@H](O)[C@H]4[C@@]5([C@H]3OC([C@@H](O)C5)(C)C)O4)[C@]6(C2)[C@@H]7C(=C)[C@@H](OC(=O)C([C@@H](O)C)(C)C)C[C@H]6C7)C[C@@H]1C
Compound: Scopararane A
SMILES: O=C1C2=C[C@@](C=C)(CC[C@]2(O)[C@]34CCCC([C@@]4([C@]1(OC3)O)O)(C)C)C
Compound: Versicone E
SMILES: O=C1C2=C(OC3=C1C(=C(OCC=C(C(=O)N)C)C(=C3)C)CO)C=CC=C2OC
Compound: JBIR-46
SMILES: OC=1C2=[N+]([O-])C=3C(=C(O)C=CC3)N=C2C(CC=C(C)C)=CC1
Compound: Antcamphorol F
SMILES: O=C1[C@H]([C@H]2[C@](C=3C([C@H]4[C@]([C@@H]([C@@H](CCC(=C)C(C)C)C)CC4)(C)[C@@H](C3)O)=CC2)(C)CC1)C
Compound: Eutypellacytosporin C
SMILES: O=C1O[C@]2(O[C@H](OCC3=C(/C=C/CCCCC)[C@@H](O)[C@H]4[C@@]5([C@H]3OC([C@@H](O)C5)(C)C)O4)[C@]6(C2)[C@@H]7C(=C)[C@@H](OC(=O)C([C@@H](O)C)(C)C)C[C@H]6C7)C[C@@H]1C
Compound: Ardeemin
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@H]4N([C@@H]5NC=6C=CC=CC6[C@@]5(C4)C(C=C)(C)C)C([C@H]2C)=O
Compound: Ganoderlactone D
SMILES: O=C1C2=C([C@@]3(C(=O)C[C@@H]([C@]3([C@@H]1O)C)[C@]4(OC(=O)CC4)C)C)[C@@H](O)C[C@@H]5[C@@]2(CC[C@@H](C5(C)C)O)C
Compound: Antcamphorol G
SMILES: O=C1[C@H]([C@H]2[C@](C=3C([C@H]4[C@]([C@@H]([C@@H](CCC(=C)C(C)C)C)CC4)(C)[C@H](C3)O)=CC2)(C)CC1)C
Compound: Eutypellacytosporin D
SMILES: O=C1O[C@]2(O[C@@H](OCC3=C(/C=C/CCCCC)[C@@H](O)[C@H]4[C@@]5([C@H]3OC([C@@H](O)C5)(C)C)O4)[C@]6(C2)[C@@H]7C(=C)[C@@H](OC(=O)C([C@@H](O)C)(C)C)C[C@H]6C7)C[C@@H]1C
Compound: Versicone F
SMILES: O=C1C2=C(OC)C(OC)=CC=C2OC3=C1C(=C(O)C(=C3)C)COC(C=C)(C)C
Compound: Leupyrrin B2
SMILES: O=C1OCC2OC(C=3NC(CC=C(C4C(OC(C=C1CC(C)C)=O)C(C(=O)O4)(CO)C)C)=CC3)=NC2/C=C\5/C(=C(/C=C/COC)\C)/COC5CC(C)C
Compound: Antcamphorol H
SMILES: O[C@@H]1C=C2C(=CC[C@@H]3[C@@]2(CC[C@@H]([C@H]3C)O)C)[C@H]4[C@]1([C@@H]([C@@H](CCC(=C)C(C)C)C)CC4)C
Compound: Purpactin C
SMILES: O=C1C=C(C=C(C12OC=3C=CC(=C(C3C2=O)OC)C(OC(=O)C)CC(C)C)C=O)C
Compound: Austalide W
SMILES: O=C1C([C@H]2[C@]([C@@H]3[C@](OC=4C(=C5COC(C5=C(C4C3)OC)=O)C)(C)C[C@H]2O)(C)CC1)(C)C
Compound: Versicone G
SMILES: O=C1C2=C(OC)C(OC)=CC=C2OC3=C1C(=C(OCC=C(C)C)C(=C3)C)COC(=O)C
Compound: 2,5-Diisobutyl-pyrazine
SMILES: N1=C(C=NC(=C1)CC(C)C)CC(C)C
Compound: Antcamphorol I
SMILES: O=C1[C@H]([C@H]2[C@](C=3C([C@H]4[C@]([C@@H]([C@@H](CCC(=C)C(C)C)C)CC4)(C)CC3)=CC2)(C)CC1)C
Compound: Oidiodendronic acid
SMILES: O=C1OCC2=CC[C@@H]3[C@@](C2=C1)(CCC[C@@]3(C(=O)O)C)C
Compound: Austalide V
SMILES: O=C1C([C@H]2[C@]([C@@H]3[C@](OC=4C(=C5COC(C5=C(C4C3)O)=O)C)(C)CC2)(C)CC1)(C)C
Compound: Erinarol D
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)CCCCCCC/C=C\C/C=C\CCCCC
Compound: Versicone H
SMILES: O=C1C2=C(OC)C(OC)=CC=C2OC3=C1C(=C(OC)C(=C3)C)CO
Compound: Arenicolin A
SMILES: O=C1C(=C[C@@H](O)[C@H]([C@@H]1OC(=O)C2=C(O)C=C(OC(=O)C3=C(O)C(=C(O)C=C3CCCCCCC)[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO)C=C2CCCCCCC)O)CO
Compound: 15-formamido-kalihinol F
SMILES: O=CNC([C@H]1O[C@]([C@@H]2[C@H]3[C@@H](N=C)[C@](O)(CC[C@@H]3[C@](N=C)(C)CC2)C)(C)CC1)(C)C
Compound: Austalide X
SMILES: O=C1OCC=2C1=C(OC)C3=C(O[C@]4(CC[C@H]([C@@]([C@H]4C3)(CCC(=O)OC)C)C(=C)C)C)C2C
Compound: Arugosin K
SMILES: O=C(C1=C2OC(C=CC2=CC=C1O)(C)C)C3=C(OC)C=C(C)C(=C3COC(=O)C)OCC=C(C)C
Compound: Diazaquinomycin J
SMILES: O=C1C=2NC(=O)C=C(C2C(=O)C3=C1NC(=O)C=C3C)CCCCCCCC(C)C
Compound: Arenicolin B
SMILES: O=C(OC1=CC(O)=C(C(=O)O)C(=C1)CCCCCCC)C2=C(O)C(=C(O)C=C2CCCCCCC)[C@@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)O)CO
Compound: 6-[(2E,6E)-10,11-dihydro-11-hydroxy-farnesyl]-5,7-dihydroxy-4-methylphthalide
SMILES: O=C1OCC=2C1=C(O)C(=C(O)C2C)C/C=C(/CC/C=C(/CCCC(O)(C)C)\C)\C
Compound: Penicillactam
SMILES: O=C1OC(O)(C(=O)NC2=C1C=CC=C2)CC3(NC(=O)C=4C=CC=CC4NC3=O)C
Compound: 6-hydroxymetatacarboline I
SMILES: O=C(N[C@H](C(=O)O)CC(C)C)C1=NC(=C2NC3=C(C2=C1)C=C(O)C=C3)CCC(=O)N4[C@H](C(=O)O)CCC4
Compound: Opantimycin A
SMILES: O=C1O[C@H](CC2=CC=CC=C2)[C@@H](C1(C)C)OC(=O)C(OC(=O)/C(/NC(=O)C3=C(O)C(NC=O)=CC=C3)=C/C)C
Compound: Pyrroloformamide C
SMILES: S1C2=C(N(C=O)C)C(=O)NC2=CSC1
Compound: Rubratoxin acid A
SMILES: O=C1C=CC[C@@H](C1)[C@H](O)[C@H]2CC(=C(C(=O)O)[C@@H]([C@@H](O)CCCCCC)[C@@H](C3=C(C2)C(=O)OC3=O)O)C(=O)O
Compound: Germicidin I
SMILES: O=C1OC(=CC(=C1C)O)CC(C)C
Compound: Gavibamycin A1
SMILES: ClC1=C(O)C(Cl)=C(C)C(=C1O)C(=O)OC2C(O)CC(OC3C(O)CC4(OC5(CC(OC6C(OC)C(OC(C6O)OC7C(O)C(OC)C(OC8OCC9OC%10(OC9C8OC(=O)C(C)C)OC(C(O)(C(=O)C)C%11C%10OCO%11)C)OC7COC)C)OC(C5O4)C)C)OC3C)OC2C
Compound: Inthomycin b
SMILES: O=C(N)C([C@H](O)\C(=C/C=C/C=C/CC=1OC=NC1)\C)(C)C
Compound: Pyrroloformamide D
SMILES: S1(SC=C2C1=C(N(C=O)C)C(=O)N2)(=O)=O
Compound: Rubratoxin acid B
SMILES: O=C1OC(=O)C2=C1[C@@H](O)[C@@H](C(=C(C(=O)O)C[C@@H](C2)[C@@H](O)[C@H](O)CCCC)C(=O)O)[C@@H](O)CCCCCC
Compound: Hericenol C
SMILES: O(C1=C(C(O)=C(COC)C(=C1)CO)C/C=C(/C/C=C/C(O)(C)C)\C)C
Compound: Stachybotrin C
SMILES: O=C1N(CC2=C1C=C(O)C3=C2O[C@@]([C@H](O)C3)(CC/C=C(/CCC=C(C)C)\C)C)CCC4=CC=C(O)C=C4
Compound: Germicidin H
SMILES: O=C1OC(=CC(=C1C)O)CCC
Compound: Ikoamide
SMILES: O=C(OC)[C@@H](N(C(=O)[C@@H](N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@H](NC(=O)[C@H](NC(=O)[C@H](N(C(=O)C[C@@H](OC)C[C@H](OC)CCC)C)[C@H](CC)C)CO)CC(C)C)C)CC(C)C)[C@H](O)C)C)[C@H](CC)C)C)CCC(=O)N)C)CC1=CC=C(OC)C=C1
Compound: Rubratoxin acid C
SMILES: O=C1OC(=O)C2=C1C[C@H](C(=C(C(=O)O)C[C@@H](C2)CCC/C=C/CO)C(=O)O)CCCCCCCC
Compound: Coprinacin B
SMILES: O=C(O[C@@H]1C2=C([C@@]3(C[C@@H]([C@@H]([C@]3(C1)CO)[C@@H]([C@@H](OC(=O)C)CC=C(C)C)C)O)C)[C@H](OC(=O)C)C[C@@H]4[C@@]2(CC[C@@H](C4(C)C)OC(=O)C)C)C
Compound: Napsamycin D
SMILES: S(CCC(NC(=O)NC(C(=O)O)CC1=CC(O)=CC=C1)C(=O)NC(C(=O)N/C=C/2\OC(N3C(=O)NC(=O)CC3)C(C2)O)C(N(C(=O)C4NC(C=5C=CC(=CC5C4)O)C)C)C)C
Compound: Germicidin J
SMILES: O=C1OC(=CC(=C1C)O)CCCC
Compound: Rufomycin NBZ3
SMILES: O=[N+]([O-])C1=C(O)C=CC(=C1)C[C@@H]2NC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](NC([C@@H](NC([C@@H](N(C([C@@H](NC2=O)C)=O)C)C[C@@H](CO)C)=O)CC(C)C)=O)C/C=C/C)CC=3C4=C(C=CC=C4)N(C3)C(C=C)(C)C)C)CC(C)C
Compound: Rubratoxin acid D
SMILES: O=C1OC(=O)C2=C1C[C@H](C(=C(C(=O)O)C[C@@H](C2)CCC/C=C/COC(=O)C)C(=O)O)CCCCCCCC
Compound: Talathermophilin B
SMILES: O=C1N[C@H](C(=O)NC1=CC=2C3=C(C4=C(OC(C)(C)C=C4)C=C3)NC2C(C=C)(C)C)C
Compound: (1R,4S,4'S,5'S,6R,6'S,8R,10E,13R,14E,16Z,20R,21R,24S)-4',21,24-trihydroxy-5',11,13,22-tetramethyl-6'-[(E)-4-methylpent-2-en-2-yl]spiro[3,7,19-trioxatetracyclo[15.6.1.14,8.020,24]pentacosa-10,14,16,22-tetraene-6,2'-oxane]-2,18-dione
SMILES: O=C1O[C@@H]2C[C@@]3(O[C@H](/C(=C/C(C)C)/C)[C@@H](C)[C@H](C3)O)O[C@@H](C2)CC=C(C[C@H](C=CC=C4[C@]5([C@H]1C=C([C@@H](O)[C@H]5OC4=O)C)O)C)C
Compound: 8-methyl-5-oxo-nonanoic acid
SMILES: O=C(O)CCCC(=O)CCC(C)C
Compound: Rufomycin NBZ1
SMILES: O=[N+]([O-])C1=C(O)C=CC(=C1)C[C@@H]2NC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](NC([C@@H](NC([C@@H](N(C([C@@H](NC2=O)C)=O)C)C[C@@H](CO)C)=O)CC(C)C)=O)C/C=C/C)CC=3C4=C(C=CC=C4)N(C3)C([C@@H]5OC5)(C)C)C)CC(C)C
Compound: Rubratoxin acid E
SMILES: O=C1OC(=O)C2=C1C[C@H](C(=C(C(=O)O)C[C@@H](C2)CCCCCC)C(=O)O)CCCCCCCC
Compound: Pseudoverticin
SMILES: O=C1NC=2C(=O)C(=C3OCOC3(C2)C(O)(C)C)C[C@H](C[C@H](OC)[C@H](O)[C@H](C=C([C@@H]([C@H](C=CC=C1C)OC)OC(=O)N)C)C)C
Compound: Teraspiridole C
SMILES: O=C1OC([C@@H]2C[C@H](OC(=O)C)[C@@]3([C@@H]([C@]2(CC1)C)CC[C@]4([C@H]3C[C@@]5(C6=C(C=CC=C6)N7[C@@H]5N[C@@H](C)C7=O)O4)C)C)(C)C
Compound: Achromosin
SMILES: O=C1NC=2C=CC=CC2C13OC(=O)C(C3)NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)CNC(=O)CC(N)C(=O)NC(C(=O)NC(C(=O)NC4C(=O)OC5(C4)C(=O)NC6=C5C=CC=C6)C(CC)C)C(O)C)C(CC)C)CO)CCC(=O)N)C(O)C
Compound: 7-Dehydrologanin tetraacetate
SMILES: COC(=O)C1=CO[C@@H](O[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@@H]2[C@@H](C)C(=O)C[C@H]12