MonarchInit/C3PO huggingface dataset:
Compound: Micropeptin KB1048
SMILES: ClC1=C(O)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@@H](CC)C)=O)C)NC(=O)[C@H](NC(=O)CCCCC)CC(=O)OC)=O)CC[C@H]3OC)[C@H](CC)C)C
Compound: L-methioninamide
SMILES: CSCC[C@H](N)C(N)=O
Compound: Urdamycin N3
SMILES: O=C1C2=C(O)C(=CC=C2C(=O)C3=C1C=C(OC)C=4C3=C(O)C=C(C)C4)[C@@H]5O[C@@H]([C@@H](O)[C@@H](C5)O)C
Compound: (2Z,3Z,3′S,6R)-6,6′-dihydroxy-1′-methoxy-2-propylidene-3′,4'-dihydro-1′H-spiro[cyclohexane-1,3′-cyclopenta[b]pyrrol]-3-ene-2′,5,5'(1′H)-trione
SMILES: O=C1C=C/C(=C/CC)/C2([C@H]1O)C(=O)N(OC)C=3[C@H]2CC(=O)C3O
Compound: Isochromophilone II
SMILES: ClC1=C2C(=COC(=C2)/C=C/C(=CC(CC)C)C)C(CC(=O)C)C(C1=O)(O)C
Compound: Lobophorin E
SMILES: O=[N+]([O-])[C@@]1([C@@H](NC(=O)OC)[C@H](O[C@H](C1)O[C@@H]2C(=C[C@@H]3C=C([C@H](C)C[C@]34OC(=O)C(C4=O)=C([C@@]5([C@H](C(=CC2)C)C=C[C@@H]6[C@@H](O[C@@H]7O[C@H]([C@H](O)[C@@H](C7)O[C@@H]8O[C@H]([C@H](O[C@H]9O[C@H]([C@H](OC)[C@@H](C9)O)C)[C@@H](C8)O)C)C)[C@@H](C)C[C@@H]([C@@H]56)C)C)O)C)C)C)C
Compound: Indiacen B
SMILES: Cl/C=C(/C=C/C1=C2C(NC=C2C=O)=CC=C1)\C
Compound: Microphycin KB921
SMILES: O=C1N2[C@H](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(N[C@H](C(N[C@@H]1C)=O)CCC(=O)N)=O)C)=O)CC3=CC=CC=C3)CC4=CC=CC=C4)CC5=CC=CC=C5)CC(C)C)CCC2
Compound: Salinipostin E
SMILES: [P@]1(=O)(OC(=C2C(=O)OC[C@H]2CO1)CC(C)C)OCCCCCCCCCCCCC
Compound: Penicimarin E
SMILES: O=C1OC(=C(COC(=O)C)C=2C1=C(O)C=C(O)C2)C
Compound: Urdamycin N4
SMILES: O=C1C2=C(O)C(=CC=C2C(=O)C3=C1C=C(O)C=4C3=C(O)C=C(C)C4)[C@@H]5O[C@@H]([C@@H](O)[C@@H](C5)O[C@@H]6O[C@H]([C@@H](O[C@@H]7O[C@@H]([C@@H](O)[C@@H](C7)O)C)CC6)C)C
Compound: (2Z,3Z,3′S,6S)-6,6′-dihydroxy-1′-methoxy-2-propylidene-3′,4'-dihydro-1′H-spiro[cyclohexane-1,3′-cyclopenta[b]pyrrol]-3-ene-2′,5,5'(1′H)-trione
SMILES: O=C1C=C/C(=C/CC)/C2([C@@H]1O)C(=O)N(OC)C=3[C@H]2CC(=O)C3O
Compound: L-methionine sulfone
SMILES: C(=O)([C@@H](N)CCS(C)(=O)=O)O
Compound: Syringolin B
SMILES: O=C1NCCCCC(NC(=O)C(NC(=O)NC(C(=O)O)C(C)C)C(C)C)C(NC(C=C1)C(C)C)=O
Compound: Micropeptin KB984
SMILES: O=C1O[C@H]([C@H](NC(=O)[C@H](NC(=O)CCCCC)CC(=O)OC)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC3=CC=CC=C3)C)=O)C(C)C)C2=O)OC)CCCN=C(N)N)C
Compound: 18-methyltacrolimu
SMILES: O=C1N2[C@H](C(=O)O[C@H](/C(=C/[C@H]3C[C@@H](OC)[C@H](O)CC3)/C)[C@@H]([C@@H](O)CC(=O)[C@H](CC=C)C=C([C@@H]([C@@H](C[C@@H]([C@H]4O[C@](C1=O)(O)[C@@H](C[C@@H]4OC)C)OC)C)C)C)C)CCCC2
Compound: Aspochalasin I
SMILES: O=C1O[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C(=C[C@@H]3C=C(CC[C@@H]([C@@H](C=C1)O)O)C)C)CC(C)C
Compound: (S)-4-butoxy-6-((S)-1-hydroxypentyl)-5,6-dihydro-2H-pyran-2-one
SMILES: O=C1O[C@H]([C@@H](O)CCCC)CC(=C1)OCCCC
Compound: Urdamycin N6
SMILES: O=C1C=2C3=C(O)C=C(C)C=C3[C@H](OC)[C@H](C2C(=O)C4=C1C=CC(=C4O)[C@@H]5O[C@@H]([C@@H](O)[C@@H](C5)O)C)OC
Compound: (10E)-isocyclonerotriol
SMILES: O[C@@]1([C@H]([C@H]([C@](O)(CC/C=C(/CO)\C)C)CC1)C)C
Compound: Anabaenopeptin KB899
SMILES: O=C1N([C@H](C(=O)N[C@H](C(=O)NCCCC[C@H](C(N[C@H](C(N[C@H]1CCC2=CC=CC=C2)=O)C(C)C)=O)NC(=O)N[C@@H](C(=O)O)CC3=CC=C(O)C=C3)[C@H](CC)C)CCC4=CC=C(O)C=C4)C
Compound: Blazeispirol V1
SMILES: O=C1C=C2[C@](C3=C([C@]45O[C@@]6(OC(C)(C)[C@H]([C@H]6O)C)[C@@H](C)[C@H]([C@@]4(C)C=C3)CC5)[C@@H]([C@H]2O)O)(C)CC1
Compound: Aculeatusquinone A
SMILES: O=C1C(OC2=C(C(O)=CC(=C2)C)C)=C(C(=O)C(=C1C)O)C
Compound: Concanamycin B
SMILES: O=C1O[C@@H]([C@@H](OC)C=CC=C(C[C@@H](C)[C@@H]([C@@H]([C@@H]([C@@H](C=C(C=C1OC)C)C)O)C)O)C)[C@H]([C@@H](O)[C@@H]([C@@]2(O[C@H](/C=C/C)[C@@H](C)[C@@H](C2)O[C@@H]3O[C@@H]([C@@H](OC(=O)N)[C@@H](C3)O)C)O)C)C
Compound: Urdamycin N7
SMILES: O=C1C=2C3=C(O)C=C(C)C=C3[C@@H](OC)[C@@H](C2C(=O)C4=C1C=CC(=C4O)[C@@H]5O[C@@H]([C@@H](O)[C@@H](C5)O)C)OC
Compound: (10Z)-isocyclonerotriol
SMILES: O[C@@]1([C@H]([C@H]([C@](O)(CC/C=C(\CO)/C)C)CC1)C)C
Compound: Micropeptin KB970A
SMILES: O=C1O[C@H]([C@H](NC(=O)[C@H](NC(=O)CCCCC)CC(=O)OC)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC3=CC=CC=C3)C)=O)C(C)C)C2=O)O)CCCN=C(N)N)C
Compound: Taichunamide D
SMILES: S(=O)(=O)(N1C2=C3C(OC(C)(C)C=C3)=CC=C2C4=C1C([C@H]5C[C@@]67CCCN7C([C@@]5(C4)NC6=O)=O)(C)C)C
Compound: Herbimycin G
SMILES: O=C1N[C@H]2C(=O)C(=C[C@H](C2)O)[C@H](OC)[C@H](C[C@H](OC)[C@H](OC)[C@H](C=C([C@@H]([C@H](C=CC=C1C)OC)OC(=O)N)C)C)C
Compound: Cyanocycline B
SMILES: O=C1C(OC)=C(C(=O)C2=C1[C@H](N3[C@H](C#N)[C@H]4C[C@H]5[C@H]6N([C@@H]2[C@@H]3[C@H]5N4)CCO6)CO)C
Compound: PF1092B
SMILES: O=C1OC2=CC3=C[C@H](OC(=O)C)[C@@H]([C@@H]([C@]3(CC2=C1C)C)C)O
Compound: Trichophenol A
SMILES: O=C1OC(C2=C(O)C=C(O)C=C2C)=CC=3C1=C(O)C=C(O)C3
Compound: Micropeptin KB970B
SMILES: O=C1O[C@H]([C@H](NC(=O)[C@H](NC(=O)CCCCC)CC(=O)O)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC3=CC=CC=C3)C)=O)C(C)C)C2=O)OC)CCCN=C(N)N)C
Compound: Aculeatusquinone B
SMILES: O=C1C(O)=C(C(=O)[C@H]([C@@]1(OC)C)OC2=C(C(O)=CC(=C2)C)C)C
Compound: Raistrickione A
SMILES: O=C(C1=CC(O)=C(C)C(=C1)O)[C@H](O)[C@H]2O[C@@H](C)CC2
Compound: Ngercheumicin H
SMILES: O=C1O[C@H]([C@H](NC(=O)C(NC(=O)CC(O)CCCCC/C=C\CCCCCC)CC(C)C)C(=O)N[C@@H](C(=O)N[C@H](C(NC(C(NC1CC(C)C)=O)CC(C)C)=O)[C@@H](O)C)CO)C
Compound: Pseudotrienic acid B
SMILES: O=C(O)/C=C/C=C/C=C/CCNC(=O)[C@H]([C@@H](O)CNC(=O)C/C=C(/C=C/C(O)CCCCCCC)\C)C
Compound: (+/-)-preisomide
SMILES: O=C(N1O[C@H](CCC1)CC(=O)OC)/C=C(/CCO)\C
Compound: Micropeptin KB970C
SMILES: O=C1O[C@H]([C@H](NC(=O)[C@H](NC(=O)CCCCC)CC(=O)OC)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1C(C)C)=O)CC3=CC=CC=C3)C)=O)C(C)C)C2=O)OC)CCCN=C(N)N)C
Compound: Bhimamycin A
SMILES: O=C1C2=C(O)C=CC=C2C(=O)C=3C1=C(OC3[C@@H](O)C)C
Compound: Colletotricholide A
SMILES: O=C1O[C@H](OC2=C1C(=C(C)C(=C2)O)C)[C@@]3(OC3)[C@@H]4CC=C5CCC[C@@H]([C@]5(C4)C)C
Compound: Micropeptin KB956
SMILES: O=C1O[C@H]([C@H](NC(=O)[C@H](NC(=O)CCC)CC(=O)OC)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC3=CC=CC=C3)C)=O)C(C)C)C2=O)OC)CCCN=C(N)N)C
Compound: Cyanopeptolin D
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)CCCCC)CC(=O)O)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1C(C)C)=O)CC3=CC=CC=C3)C)=O)CC(C)C)C2=O)O)CCCCN(C)C)C
Compound: 8-O-beta-D-glucopyranosyl-6-methyl-1-carboxylate methyl ester xanthone
SMILES: O=C1C2=C(OC3=C1C(C(=O)OC)=CC=C3)C=C(C)C=C2O[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO
Compound: Raistrickione B
SMILES: O=C(C1=CC(O)=C(C)C(=C1)O)[C@@H](O)[C@@H]2O[C@@H](C)CC2
Compound: Colletotricholide B
SMILES: O=C1O[C@@H](OC2=C1C(=C(C)C(=C2)O)C)[C@@]3(OC3)[C@H]4C[C@@]5(C(=CCC[C@H]5C)CC4)C
Compound: Brevione E
SMILES: O=C1C(=C(O[C@@]23[C@H](C1)O[C@H](OC(=O)C)[C@]24[C@@H]5[C@]6([C@@H](C(=CC(C[C@H]6O[C@H]5C=C3C)=O)C)CC4)C)C)C
Compound: Anabaenopeptin KB906
SMILES: O=C1N([C@H](C(=O)N[C@H](C(=O)NCCCC[C@H](C(N[C@H](C(N[C@H]1CCC2=CC=CC=C2)=O)[C@H](CC)C)=O)NC(=O)N[C@H](C(=O)O)CCCN=C(N)N)[C@H](CC)C)CCC3=CC=C(O)C=C3)C
Compound: Roseobacticide F
SMILES: S(SC)C=1C=C2OC(=O)C(=C2C=CC1)C=3C4=C(C=CC=C4)NC3
Compound: Karuquinone B
SMILES: O=C1C2=C(O)C(=C(C)C(=C2[C@@H](O)CC1)O)CC(=O)C
Compound: Raistrickione C
SMILES: O=C(C1=CC(O)=C(C)C(=C1)O)[C@H](O)[C@@H]2O[C@@H](C)CC2
Compound: Boremexin A
SMILES: O=C1OC2=C(C(=CC(=C2)O)C)OC3=C1C(=C(OC)C4=C3C=C[C@@H](O4)C(=O)OC)C
Compound: Micropeptin KB928
SMILES: O=C1O[C@H]([C@H](NC(=O)[C@H](NC(=O)CCC)CC(=O)O)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC3=CC=CC=C3)C)=O)C(C)C)C2=O)O)CCCN=C(N)N)C
Compound: WF-14865A
SMILES: O=C(O)[C@@H]1[C@@H](C(=O)N[C@H](C(=O)NCCCC=2NC(N)=NC2)[C@H](CC)C)C1
Compound: Elansolid B1
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](O)C3=CC=C(O)C=C3)(C)C)C)C)C
Compound: Raistrickione D
SMILES: O=C(C1=CC(O)=C(C)C(=C1)O)[C@]2(O[C@H](CCC2)C)OC
Compound: Bombardolide A
SMILES: O=C1O/C(=C\CC)/C=C1/C=C/CO
Compound: Boremexin B
SMILES: O=C1OC2=C(C(=CC(=C2)O)C)OC3=C1C(=C(OC)C4=C3C=C[C@H](O4)C(=O)OC)C
Compound: Aeruginosin KB676
SMILES: O=C(NCCCCN(C(=N)N)CC=C(C)C)[C@H]1N(C(=O)[C@H](NC(=O)[C@H](O)CC2=CC=C(O)C=C2)CC3=CC=CC=C3)[C@H]4C[C@@H](O)CC[C@H]4C1
Compound: Tyroscherin
SMILES: OC1=CC=C(C[C@@H](NC)[C@H](O)CC/C=C/[C@H](C[C@H](CC)C)C)C=C1
Compound: Polisin C
SMILES: O=C1O[C@]([C@H]2C[C@H](O)[C@H](C)CC2)(C)CC1
Compound: Raistrickione E
SMILES: O=C(C=1O[C@H](CCC1)C)C2=CC(O)=C(C)C(=C2)O
Compound: Clitocybulol D
SMILES: O1[C@@]2(O)[C@](O)(C3=C(CC([C@@H]3O)(C)C)[C@H]([C@@H]2O)C)C(C1)=C
Compound: Boremexin C
SMILES: O=C1OC2=C(C(=CC(=C2)O)C)OC3=C1C(=C(OC)C(=C3/C=C/[C@@H](O)C(=O)OC)O)C
Compound: Leptosine M
SMILES: S1SS[C@@]23N([C@H]4NC=5C=CC=CC5C4([C@H]2O)[C@]67C8=C(C=CC=C8)N[C@H]6N9C(=O)C(CO)N(C([C@]9([C@@H]7O)OC)=O)C)C(C(S1)(N(C)C3=O)C(C)C)=O
Compound: Nuiapolide
SMILES: O=C1OC(C(C)(C)C)CC(O)CCCC(O)CCCC(O)CCCC(O)CCCC(O)CCCC(CCCC(CCCC(CC(CCCC(=C1)C)O)O)O)O
Compound: Acremoxanthone A
SMILES: O=C1C2=C(O)C3=C(C[C@@]45[C@@H](OC(=O)C)C=6C=C(C)C=C(C6C(=C5C([C@H]3C=C4)=O)O)O)C=C2OC=7C1=C(C(O)=CC7)C(=O)OC
Compound: Albisporachelin
SMILES: O=C1N(O)CCC[C@@H]1N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC)CCCN(O)C=O)CO)CCCN(O)C=O)C
Compound: Preubetaomerin H
SMILES: O=C1C2=C(O)C=CC3=C2[C@@]4(OC=5C=CC=C6C5[C@@](O3)(CCC6=O)O4)[C@H]7[C@@H]1O7
Compound: Boremexin D
SMILES: O=CC1=C(O)C(OC)=C(C)C=C1OC2=C(O)C=C(O)C=C2C
Compound: Carmaphycin B
SMILES: S(=O)(=O)(CC[C@H](NC(=O)[C@@H](NC(=O)CCCCC)C(C)C)C(=O)N[C@H](C(=O)[C@@]1(OC1)C)CC(C)C)C
Compound: Cristazarin
SMILES: O=C1C2=C(O)C(O)=C(CC)C(=C2C(=O)C=C1OC)O
Compound: Neoantimycin D
SMILES: O=C1O[C@H](C(=O)O[C@H]([C@H](NC(=O)C2=C(O)C(N)=CC=C2)C(=O)O[C@H](C(O[C@@H]([C@@H](C1(C)C)O)CC3=CC=CC=C3)=O)C(C)C)C)[C@H](CC)C
Compound: Asperindole A
SMILES: ClC1=CC=2NC=3[C@@]4([C@@]5([C@](O)(C6=CC(=O)[C@H]7[C@](OC(=O)C)(C)CO[C@@]6(O7)CC5)CC[C@H]4CC3C2C=C1)C)C
Compound: 7-prenylisatin
SMILES: O=C1NC=2C(=CC=CC2C1=O)CC=C(C)C
Compound: Boremexin E
SMILES: O=C(OC)C1=C(OC2=CC(O)=CC(=C2)C)C(OC)=CC(=C1)O
Compound: Carmaphycin A
SMILES: S(=O)(CC[C@H](NC(=O)[C@@H](NC(=O)CCCCC)C(C)C)C(=O)N[C@H](C(=O)[C@@]1(OC1)C)CC(C)C)C
Compound: Chartarlactam E
SMILES: O=C1C([C@H]2[C@]([C@]3(OC=4C5=C(C(=O)NC5)C=C(C4C3)O)[C@H](C)CC2)(C)CC1)(C)C
Compound: Deconin A
SMILES: O=C(OCC[C@@](O)(CC(=O)O)C)C1=CC=C([C@@]2(C(CCC2)(C)C)C)C=C1
Compound: Multiforisin A
SMILES: O=C1OC(=C(C=O)C(=C1CO)OC)/C=C/C
Compound: Asperindole B
SMILES: O=C1C=C2[C@@]3(OC[C@@]([C@H]1O3)(OC(=O)C)C)CC[C@]4([C@@]2(O)CC[C@@H]5[C@@]4(C=6NC=7C=CC=CC7C6C5)C)C
Compound: Chevalone G
SMILES: O=C1OC(=CC2=C1C[C@]3([C@]4([C@@H]([C@@]5([C@H](C(C(=O)CC5)(C)C)CC4)C)CC[C@@H]3O2)C)C)C
Compound: Minutibetaamide G
SMILES: O=C/1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(N2[C@H](C(N[C@@H]([C@H](C(N[C@H](C(N\C1=C\C)=O)C(C)C)=O)O)[C@H](CCCCCCCCCCC(O)CCC)C)=O)CCC2)=O)CC(=O)N)C)[C@H](OC)C)C)CCC(=O)N)[C@H](O)C)[C@H](O)C
Compound: Rhodopeptin C4
SMILES: O=C1N[C@@H](CC(=O)NCC(N[C@H](C(N[C@H]1C(C)C)=O)CCCN)=O)CCCCCCCCC(CC)C
Compound: Pestalotiopen B
SMILES: Cl[C@@H]1C([C@]23O[C@H]2C[C@]([C@@H]([C@@]3(C)CC1)C(=O)O)(OCC4=C(O)C(=C5[C@@H](OC)OC(C5=C4OC)=O)[C@@H]6O[C@@H](C[C@@H](O6)C)CC(=O)OC)C)(C)C
Compound: Hapalosin
SMILES: O=C1O[C@H](C(=O)N([C@H]([C@H](O)CC(O[C@@H]([C@@H]1C)CCCCCCC)=O)CC2=CC=CC=C2)C)C(C)C
Compound: Asperindole C
SMILES: ClC1=CC=2NC=3[C@@]4([C@@]5([C@](O)(C6=CC(=O)[C@H]7[C@](OC(=O)C(OC(=O)C)(C)C)(C)CO[C@@]6(O7)CC5)CC[C@H]4CC3C2C=C1)C)C
Compound: Aszonapyrone C
SMILES: O=C1C(=C(O)C=C(C1)C)C/C=C(/CC[C@H]2C(=CC[C@@H]3[C@@]2(CC[C@@H](C3(C)C)OC(=O)C)C)C)\C
Compound: Glisoprenin A
SMILES: OC(CCC=C(C)C)(CCCC(O)(CCCC(O)(CCCC(O)(CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C
Compound: Minutibetaamide H
SMILES: O=C/1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(N2[C@H](C(N[C@@H]([C@H](C(N[C@H](C(N\C1=C\C)=O)C(C)C)=O)O)[C@H](CCCCCCCCCCC(=O)CCC)C)=O)CCC2)=O)CC(=O)N)C)[C@H](OC)C)C)CCC(=O)N)[C@H](O)C)C(C)C
Compound: Hyalodendroside B
SMILES: O=C1C2=C3[C@]([C@]4([C@@H]([C@@]5([C@H](C([C@@H](O[C@@H]6O[C@@H]([C@@H](O)[C@@H]([C@H]6O)O)CO)[C@@H](C5)OC(=O)C)(C)C)CC4)CO)CC3)C)(CCC2(C)C(C1)C(C)C)C
Compound: 3,4-dihydroglobosuxanthone A
SMILES: O=C1C2=C(OC3=C1[C@](O)(C(=O)OC)[C@H](O)CC3)C=CC=C2O
Compound: Asperindole D
SMILES: O=C1C=C2[C@@]3(OC[C@@]([C@H]1O3)(OC(=O)C(OC(=O)C)(C)C)C)CC[C@]4([C@@]2(O)CC[C@@H]5[C@@]4(C=6NC=7C=CC=CC7C6C5)C)C
Compound: L-phenylalanine amide
SMILES: N[C@@H](Cc1ccccc1)C(N)=O
Compound: Minutibetaamide I
SMILES: O=C/1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N([C@H](C(N2[C@H](C(N[C@@H]([C@H](C(N[C@H](C(N\C1=C\C)=O)C(C)C)=O)O)[C@H](CCCCCCCCCCC(=O)CCC)C)=O)CCC2)=O)CC(=O)N)C)[C@H](OC)C)CCC(=O)N)[C@H](O)C)[C@H](O)C
Compound: 7-chlorofischerindoline
SMILES: ClC1=C2N([C@H]3N[C@H](C(=O)O[C@@H]4[C@]5(O)[C@H](C=C([C@H]4OC(=O)C)C)[C@H](C(=C)C)CC[C@H]5C)C[C@]3(C2=CC=C1)O)C
Compound: Ambiguine P
SMILES: O[C@]12C3=C(C=CC(C4=C3C=5C(=CC=CC5C1(C)C)N4)(C)C)[C@](C=C)(C)CC2
Compound: Fluostatin B
SMILES: O=C1C2=C(C=3C(=O)C=4C=CC=C(C4C3C(=C2)O)O)C(O)C(C1C)O
Compound: Trichorzin PA V
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CO)CC=2C3=C(C=CC=C3)NC2)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)(CC)C)(CC)C)CCC(=O)N)(C)C)C(C)C)(C)C)CC(C)C)(C)C
Compound: Gliomasolide F
SMILES: O=C1O[C@]([C@@H](O)/C=C/C)(C)C=C1
Compound: Brasiliamide H
SMILES: O=C(N1[C@]2(C(C3=CC=CC=C3)[C@@H](C1)N(C2)C(=O)C)[C@@H](O)C4=CC(OC)=C5OCOC5=C4)C
Compound: Minutibetaamide J
SMILES: ClC(CCCCCCC[C@@H]([C@H]1NC(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)N)NC([C@@H](NC([C@@H](NC(\C(\NC([C@@H](NC([C@@H]1O)=O)C(C)C)=O)=C/C)=O)[C@H](O)C)=O)[C@H](O)C)=O)[C@H](OC)C)C)CC(=O)N)CCC2)C)CC
Compound: Micropeptin MZ771
SMILES: O=C1O[C@@H]([C@H](N)C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC3=CC=CC=C3)C)=O)[C@H](CC)C)C2=O)OC)CCCN=C(N)N)C
Compound: Julichrome Q3-5
SMILES: O=C1C2=C(C(=O)C3=C1C(=O)C(=C4C(O)=C5C(=C(O)[C@]67[C@H]([C@](O)(C)CC([C@]7([C@@H]5O)O6)=O)[C@H](OC(=O)C)C)C=C4)C=C3)C(C(C)=CC2=O)=C(O)C
Compound: 13-O-prenyl-26-hydroxyverruculogen
SMILES: O=C1N2[C@H](C(=O)N3[C@@]1(O)[C@@H](OCC=C(C)C)C=4C5=C(C=C(OC)C=C5)N6C4[C@@H]3[C@H](O)C(OO[C@@H]6C=C(C)C)(C)C)CCC2
Compound: Subnudatone A
SMILES: O=C1C(=CO[C@@]2([C@@]1([C@H]3[C@@H](C[C@@H](C)CC3)C=C2)C)C)/C=C/C(=O)[C@@]4([C@@](O)(C=C[C@@H]5[C@@H]4CC[C@H](C5)C)C)C
Compound: Gliomasolide G
SMILES: O=C1O[C@@H](C=CC)[C@@H](C)[C@H](C1)O
Compound: Thelephantin C
SMILES: O=C(OC1=C(O)C(=C(OC(=O)C[C@@H](C(C)C)C)C(=C1C2=CC=C(O)C=C2)O)C3=CC=C(O)C=C3)C4=CC=C(O)C=C4
Compound: Hypomurocin B-4
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)CC(C)C)(C)C)CCC(=O)N)(C)C)C(C)C)(C)C)(CC)C)(C)C
Compound: Minutibetaamide K
SMILES: O=C/1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N([C@H](C(N2[C@H](C(N[C@@H]([C@H](C(N[C@H](C(N\C1=C\C)=O)C(C)C)=O)O)[C@H](CCCCCCCCCCC(O)CCC)C)=O)CCC2)=O)CC(=O)N)C)[C@H](OC)C)CCC(=O)N)[C@H](O)C)[C@H](O)C
Compound: Demycarosyl-3D-beta-D-digitoxosyl-mithramycin
SMILES: O=C1C2=C(O)C3=C(O)C(=C(O[C@@H]4O[C@@H]([C@@H](O)[C@@H](C4)O[C@@H]5O[C@@H]([C@@H](O)[C@@H](C5)O)C)C)C=C3C=C2C[C@H]([C@@H]1O[C@@H]6O[C@@H]([C@@H](O)[C@@H](C6)O[C@@H]7O[C@@H]([C@H](O)[C@@H](C7)O[C@@H]8O[C@@H]([C@@H](O)[C@H](C8)O)C)C)C)[C@H](OC)C(=O)[C@@H](O)[C@H](O)C)C
Compound: Subnudatone B
SMILES: O=C1C=CO[C@]2([C@]1([C@@H]3[C@H](C[C@H](C)CC3)C=C2)C)C
Compound: Gliomacid A
SMILES: O=C(O)/C=C/[C@@H]([C@@H](O)/C=C/C)C
Compound: Dihydrotubingensin B
SMILES: O[C@@H]1[C@@]23C4=C([C@@](C(C)C)(CC2)CC[C@]3([C@H](C)CC1)C)CC=5NC6=C(C5C4)C=CC=C6
Compound: Minutibetaamide L
SMILES: O=C/1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N([C@H](C(N2[C@H](C(N[C@@H]([C@H](C(N[C@H](C(N\C1=C\C)=O)C(C)C)=O)O)[C@H](CCCCCCCCCCC(=O)CCC)C)=O)CCC2)=O)CC(=O)N)C)[C@H](OC)C)CCC(=O)N)[C@H](O)C)C(C)C
Compound: (5alpha,6beta,15beta,22E)-6-ethoxy-5,15-dihydroxyergosta-7,22-dien-3-one
SMILES: O=C1C[C@@]2(O)[C@]([C@@H]3C([C@H]4[C@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)C[C@H]4O)(C)CC3)=C[C@H]2OCC)(C)CC1
Compound: Emindole PA
SMILES: O1[C@@H]2[C@]([C@H]3C(C([C@H](CC=4C5=C(C=CC=C5)NC4C(C=C)(C)C)CC3)(C)C)=CC2)(CC[C@H]1C(O)(C)C)C
Compound: Cordycepamide A
SMILES: O=C(NC1C(OC=2C(O)=CC=CC2C1)O)/C=C/CCCCCCC
Compound: Gliomacid B
SMILES: O=C(O)CC[C@@H](/C=C\C(O)C)C
Compound: Nebularilactone B
SMILES: O=C1OC[C@H]2C1=CC[C@H]3C(CC[C@@H]([C@]23C)O)(C)C
Compound: Minutibetaamide E
SMILES: O=C/1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(N2[C@H](C(N[C@@H]([C@H](C(N[C@H](C(N\C1=C\C)=O)C(C)C)=O)O)[C@H](CCCCCCCCCCC(=O)CCC)C)=O)CCC2)=O)CC(=O)N)C)[C@H](OC)C)C)CCC(=O)N)[C@H](O)C)[C@H](O)C
Compound: FR182877
SMILES: O=C1O[C@H]2[C@H](C)C3=C1[C@@H]4[C@H]5[C@@H]6[C@@H](O)[C@H](C)[C@H]([C@H]6C=C([C@H]5C[C@@H]4[C@@](O3)(C)CC2)C)O
Compound: Cordycepamide B
SMILES: O=C(NC1C(OC=2C=CC=CC2C1)O)/C=C/CCCCCCC
Compound: Fumiquinazoline S
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@@H](NC([C@H]2C[C@@]4(O)C5=C(C=CC=C5)N6[C@H]4N[C@@H](C(C)C)C6=O)=O)C
Compound: L-prolinamide
SMILES: NC(=O)[C@@H]1CCCN1
Compound: 6-(5-carboxy-3-methylpent-2-enyl)-7-hydroxy-3,5-dimethoxy-4-methylphthalan-1-one
SMILES: O=C1O[C@H](OC)C=2C1=C(O)C(=C(OC)C2C)CC=C(CCC(=O)O)C
Compound: Aspereline A
SMILES: O=C(N1[C@@H](CCC1)CO)C(NC(=O)[C@@H](NC(=O)C(NC(=O)C(NC(=O)[C@@H](NC(=O)C(NC(=O)[C@@H](NC(=O)C(NC(=O)C(NC(=O)C)(C)C)(C)C)C(C)C)(C)C)[C@H](CC)C)(C)C)(C)C)C)(C)C
Compound: Cordycepamide C
SMILES: O=C(N[C@H](CO)CC1=C(O)C=CC=C1)/C=C/CCCCCOC(=O)C
Compound: Vineomycin B2
SMILES: O=C1C2=C(O)C(=CC=C2C(=O)C3=C1C=CC(=C3O)C[C@@](O[C@@H]4O[C@H]([C@@H](O[C@@H]5O[C@H](C(=O)C=C5)C)CC4)C)(CC(=O)O)C)[C@@H]6O[C@@H]([C@@H](O[C@@H]7O[C@H]([C@@H](O[C@@H]8O[C@H](C(=O)C=C8)C)CC7)C)[C@@H](C6)O)C
Compound: Minutibetaamide F
SMILES: ClC(CCCCCCC[C@@H]([C@H]1NC(=O)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@H](CCC(=O)N)NC([C@@H](NC([C@@H](NC(\C(\NC([C@@H](NC([C@@H]1O)=O)C(C)C)=O)=C/C)=O)[C@H](O)C)=O)[C@H](O)C)=O)C)[C@H](OC)C)C)CC(=O)N)CCC2)C)CC
Compound: Leporizine A
SMILES: S1S[C@@]23N(C4CC=5O[C@H](C)C(C5C(C4([C@@H]2O)O)=O)(C)C)C([C@]6(S1)N([C@@H]7NC=8C=CC=CC8C7([C@@H]6O)O)C3=O)=O
Compound: 6-(5-methoxycarbonyl-3-methylpent-2-enyl)-3,7-dihydroxy-5-methoxy-4-methylphthalan-1-one
SMILES: O=C1O[C@H](O)C=2C1=C(O)C(=C(OC)C2C)CC=C(CCC(=O)OC)C
Compound: Friulimicin B
SMILES: O=C1N2C(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NCC(NC(C(NC(C(N3C(C(NC(C1NC(=O)C(NC(=O)C/C=C/CCCCCCCC(C)C)CC(=O)N)C)=O)CCC3)=O)C(C)C)=O)C(N)C)=O)CC(=O)O)CC(=O)O)C(C(=O)O)C)CCCC2
Compound: Cordycepamide D
SMILES: O=C(N[C@H](CO)CC1=C(O)C=CC(=C1)O)/C=C/CCCCCCCOC(=O)C
Compound: Nodulapeptin 885
SMILES: S(CCC1NC(=O)C(N(C(=O)C(NC(=O)C(C(C)C)NC(C(CCCCNC1=O)NC(=O)NC(C(=O)O)CC2=CC=CC=C2)=O)CCC3=CC=CC=C3)C)CCC4=CC=CC=C4)C
Compound: Trichovirin II 3b
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CO)CC(C)C)CCC(=O)N)(C)C)(C)C)CC(C)C)CCC1)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C)(C)C)C)CC(C)C)(CC)C)CCC(=O)N)(CC)C)(C)C)(C)C)(C)C)(C)C
Compound: 3,8-dihydroxy-1-methyl-anthraquinone-2-carboxylic acid
SMILES: O=C1C2=C(O)C=CC=C2C(=O)C3=C1C(=C(C(=O)OC)C(=C3)OC)C
Compound: 6-(3-carboxybutyl)-7-hydroxy-5-methoxy-4-methylphthalan-1-one
SMILES: O=C1OCC=2C1=C(O)C(=C(OC)C2C)CC[C@@H](C(=O)O)C
Compound: 3,3,8,8-tetramethyl-1,2,5,6-tetrathiocane
SMILES: S1SC(CSSCC1(C)C)(C)C
Compound: Cordycepamide E
SMILES: O=C1O[C@@H](C(=O)N([C@H]1CC2=CC=C(O)C=C2)C)C(C)C
Compound: Trichopolyn I
SMILES: O=C(NC(C(=O)N[C@H](C(=O)N[C@H](C(=O)NC(C(=O)NC(C(=O)N[C@H](CN(CCO)C)C)(C)C)(C)C)C)[C@H](CC)C)(C)C)C(NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1N(C(=O)[C@@H](CCCCCCCC)C)CCC1)C[C@@H](C[C@H](O)CC(=O)CC)C)C)(C)C
Compound: Nodulapeptin 863
SMILES: O=C1N(C(C(=O)NC(C(=O)NCCCCC(C(NC(C(NC1CCC2=CC=CC=C2)=O)C(CC)C)=O)NC(=O)NC(C(=O)O)C(CC)C)COC(=O)C)CCC3=CC=CC=C3)C
Compound: 6-[5-(2,3-dihydroxy-1-carboxyglyceride)-3-methylpent-2-enyl]-7-hydroxy-5-methoxy-4-methylphthalan-1-one
SMILES: O=C1OCC=2C1=C(O)C(=C(OC)C2C)CC=C(CCC(=O)OC[C@@H](O)CO)C
Compound: Cordyglycoside A
SMILES: O=C(O)CCCCC/C=C/C=C/C(O[C@@H]1O[C@@H]([C@@H](OC)[C@@H]([C@H]1O)O)CO)CCCCCCC
Compound: Strobilurin O
SMILES: O=C(OC)\C(\C(=C/C=C/C1=CC=2OC(C(OC[C@H]3OC3(C)C)COC2C=C1)(C)C)\C)=C\OC
Compound: Oxosorbiquinol
SMILES: O=C1C(=C(O)C(C)=C([C@]1(O)C)O)C(=O)[C@H]2[C@H]3\C(\C(=O)[C@]([C@@H]2/C=C/C)(C)C([C@]3(O)C)=O)=C(\O)/C=C/C=C/C
Compound: 6-[5-(1-carboxy-4-N-carboxylate)-3-methylpent-2-enyl]-7-hydroxy-5-methoxy-4-methylphthalan-1-one
SMILES: O=C1OCC=2C1=C(O)C(=C(OC)C2C)CC=C(CCC(=O)NCCCC(=O)O)C
Compound: Nodulapeptin 849
SMILES: O=C1N(C(C(=O)NC(C(=O)NCCCCC(C(NC(C(NC1CCC2=CC=CC=C2)=O)C(C)C)=O)NC(=O)NC(C(=O)O)C(CC)C)COC(=O)C)CCC3=CC=CC=C3)C
Compound: Actinopyrone C
SMILES: O=C1C(=C(OC(=C1C)C/C=C(/C/C=C/C(=C/[C@H]([C@H](O)/C(=C\C)/C)C)/C)\C)OC)CC
Compound: 2-Acetoxyrhizopogone
SMILES: O=C1C(=O)C2(OC(=O)C)C(=O)C(=C1CC=C(CCC=C(C)CCC=C(C[C@H]2C=C(C)C)C)C)O
Compound: Salfredin 8
SMILES: O=C1N(CC2=C1C=C3OC([C@H](C(=O)O)C)CC3=C2O)CCC4=CC=CC=C4
Compound: 2,6-dihydroxy-4-[(2R)-2-hydroxyheptyl]benzoic acid
SMILES: O=C(O)C1=C(O)C=C(C[C@H](O)CCCCC)C=C1O
Compound: Elaiomycin E
SMILES: O(C[C@H](/N=[N+](\[O-])/C=C/C(O)CCCCC)[C@@H](O)C)C
Compound: Nodulapeptin 839
SMILES: S(CCC1NC(=O)C(NC(=O)NC(C(=O)O)C(CC)C)CCCCNC(=O)C(NC(C(N(C(C(NC1=O)CCC2=CC=CC=C2)=O)C)CCC3=CC=CC=C3)=O)CO)C
Compound: Chaetoviridin K
SMILES: ClC1=C2C(=COC(=C2)C=CC(O)(CC)C)[C@@H]3[C@H]4C(=O)O[C@@H]([C@H]([C@]4(O[C@@]3(C1=O)C)O)C)C
Compound: Dichocetide B
SMILES: [S@@](=O)(C1=C(OC)C=2C(=CC=CC2)C(=C1)OC)C
Compound: 5aTHQ-9i
SMILES: N1C2=C(C(=CC=C2)CCCCCCC(C)C)CCC1
Compound: Azinomycin A
SMILES: O=C(OC(C(=O)N/C(=C\1/N2[C@@H](C2)[C@H]([C@@H]1OC(=O)C)O)/C(=O)NCC(=O)C)C3(OC3)C)C=4C=5C(=C(C=CC5)C)C=C(C4)OC
Compound: Penisochroman B
SMILES: O=C(O)C1=C(O)C2=C(C[C@@H](CCCCCO)O[C@@H]2OC)C=C1O
Compound: Nodulapeptin 807
SMILES: O=C1N(C(C(=O)NC(C(=O)NCCCCC(C(NC(C(NC1CCC2=CC=CC=C2)=O)C(C)C)=O)NC(=O)NC(C(=O)O)C(CC)C)CO)CCC3=CC=CC=C3)C
Compound: Byelyankacin
SMILES: O1C(OC2=CC=C(/C=C/C#N)C=C2)C(O)C(O)C(C1C)O
Compound: Dichocetide C
SMILES: O=C(CC1=CC(OC)=C(OC)C(=C1)OC)CCC2=CC=C(OC)C=C2
Compound: Chejuenolide B
SMILES: O=C1C(=CC[C@H](O)C=CC(=CC[C@H](C=CC(=C[C@@H]([C@@H]1C)NC(=O)C)C)O)C)C
Compound: 5-Hydroxy-3-(1-hydroxy-2-methylpropyl)-4-methyl-2(5H)-furanone
SMILES: O=C1OC(O)C(=C1C(O)C(C)C)C
Compound: Penisochroman A
SMILES: O=C(O)C1=C(O)C2=C(C[C@@H](CCCCC)O[C@@H]2OC)C=C1O
Compound: Nodulapeptin 821
SMILES: O=C1N(C(C(=O)NC(C(=O)NCCCCC(C(NC(C(NC1CCC2=CC=CC=C2)=O)C(CC)C)=O)NC(=O)NC(C(=O)O)C(CC)C)CO)CCC3=CC=CC=C3)C
Compound: Dichotomocej E
SMILES: O=C(OC)C1=NC(=C(CC2=CC(OC)=C(OC)C(=C2)OC)N=C1)CC3=CC=C(OC)C=C3
Compound: (E)-2-[[(2S,3R)-1-[3-chloro-5-(diaminomethylideneamino)-4-hydroxy-2-[[4-hydroxy-3-(3-prop-1-en-2-ylquinolin-4-yl)benzoyl]amino]pentanoyl]-3-hydroxy-3-methylpyrrolidine-2-carbonyl]amino]-3-methylpent-2-enoic acid
SMILES: ClC(C(NC(=O)C1=CC(C=2C=3C(N=CC2C(=C)C)=CC=CC3)=C(O)C=C1)C(=O)N4[C@H](C(=O)N/C(/C(=O)O)=C(/CC)\C)[C@@](O)(C)CC4)C(O)CN=C(N)N
Compound: Acremodiol
SMILES: O=C1O[C@@H]([C@H](O)CCC(=O)O[C@@H](CC[C@H](C=C1)O)C)C
Compound: 1,2,3,5,6-pentahydroxy-8-methylxanthone
SMILES: O=C1C2=C(O)C(O)=C(O)C=C2OC3=C1C(=CC(=C3O)O)C
Compound: Nodulapeptin 851
SMILES: S(CCC1NC(=O)C(N(C(=O)C(NC(=O)C(C(C)C)NC(C(CCCCNC1=O)NC(=O)NC(C(=O)O)C(CC)C)=O)CCC2=CC=CC=C2)C)CCC3=CC=CC=C3)C
Compound: 3-hydroxy-5-phenylmethyl-(3S,5R)-tetrahydrofuran-2-one
SMILES: O=C1O[C@H](CC2=CC=CC=C2)C[C@@H]1O
Compound: Palmarumycin CP18
SMILES: O=C1C2=C(C(=O)C=C1)[C@@H](O)CCC23OC=4C=5C(C=CC4)=CC=CC5O3
Compound: Dichotomocej F
SMILES: O=C1NC2=C(C3=C(OC)C(OC)=C(C=C3C=C2N1)OC)C4=CC=C(OC)C=C4
Compound: Versimide
SMILES: O=C1N(C(=O)C[C@H]1C)C(C(=O)OC)=C
Compound: TAN-1323C
SMILES: O=C1O[C@@H]([C@@H](OC)C=CC=C(C[C@@H](C)[C@@H]([C@@H]([C@@H]([C@@H](C=C(C=C1OC)C)C)O)CC)O)C)[C@H]([C@@H](O)[C@@H]([C@@]2(O[C@H](/C=C/C)[C@@H](C)[C@@H](C2)O[C@@H]3O[C@H]([C@H](O)[C@H]([C@H]3O)O)C)O)C)C
Compound: Saturnispol H
SMILES: O=C1OC(=CC(=C1C)O)/C=C/C=C/CO
Compound: Flavimycin A
SMILES: O1C(O)C=2C(=C(O)C(=C(C2[C@H]1[C@@H]3OCC=4C3=C(O)C(O)=C(O)C4C)O)O)C
Compound: Versicobenzo B
SMILES: O=C1OCC=2C1=C(O)C(OC)=C(O)C2C
Compound: Laucysteinamide A
SMILES: S1C(=N[C@@H](C1)/C=C/CCCCCCCCCCC(=O)N(/C=C/CC=C)C)C
Compound: Neomarinone
SMILES: O=C1C(=O)C(=C(O)C2=C1C=C(O)C3=C2O[C@H](C)[C@]3(C/C=C(\C4(C(CCC4)C)C)/C)C)C
Compound: Saturnispol A
SMILES: O=C1C(=C(O)C(=C(O)/C=C/C=C/CO)[C@H]2[C@@]1(O[C@@]3(O)[C@@](O)(CC(C([C@@]23C)=O)=C(O)/C=C/C=C/CO)C)C)C
Compound: Welwitindolinone A isonitrile
SMILES: Cl[C@H]1[C@](C([N+]#[C-])=C2[C@]3(C(=O)NC4=C3C=CC=C4)C([C@H]2C1)(C)C)(C=C)C
Compound: Actinoramide C
SMILES: O=C(N[C@H]([C@@H](O)CC)CC1=CC=CC=C1)[C@H]2N(NCCC2)C(=O)[C@H](NC(=O)COC)[C@H](O)C(C)C
Compound: Fusaprolifin B
SMILES: O=C1C(O)=C([C@@H](COC(=O)C)C)[C@@H]2[C@@]1(CC=C(CC[C@@H]3C(=C)CC[C@H](C(=CC2)C)O3)C)C
Compound: Versicoisochromane A
SMILES: O=C1O[C@@H]([C@H](O)C=2C1=C(O)C(=CC2C)C)C
Compound: Microginin KR781
SMILES: O=C(N[C@H](C(=O)OC)CC1=CC=C(O)C=C1)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@H](O)[C@H](NC)CCCCCCC)CC3=CC=C(O)C=C3)C)CC(C)C)CCC2
Compound: Saturnispol B
SMILES: O=C1C(=C(O)C(=C(O)/C=C/C=C/CO)[C@H]2[C@@]1(O[C@@]3(O)[C@@](O)(CC(C([C@@]23C)=O)=C(O)/C=C/C=C/C)C)C)C
Compound: Alternethanoxin E
SMILES: O=C(C1=C2OC=3C=C(OC)C=C4C3C2=C(O[C@@H]4O)C(=C1)O)C
Compound: (1S,2S,4aR,6S,8-S,8aS,3′S,5′R,2′′S)-methyl 1,2,4a,5,6,7,8,8a-octahydro-3′,5′-dihydroxy-2,6-dimethyl-8-[(2-methyl-1-oxobutyl)oxy]-1-naphthaleneheptanoate
SMILES: O=C(O[C@@H]1[C@H]2C(C=C[C@@H]([C@@H]2CC[C@@H](O)C[C@@H](O)CC(=O)OC)C)=C[C@@H](C1)C)[C@H](CC)C
Compound: Tsugicoline M
SMILES: O=C(O)C=1OC=C2C1C(=C3[C@@H](CC(C3)(C)C)[C@@H]2O)C
Compound: Versicoisochromane B
SMILES: O=C1O[C@@H](CC=2C1=C(O)C(=CC2CO)C)C
Compound: Microginin KR815
SMILES: ClCCCCCCC[C@@H](NC)[C@@H](O)C(=O)N[C@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)OC)CC2=CC=C(O)C=C2)CCC1)CC(C)C)C)CC3=CC=C(O)C=C3
Compound: Saturnispol C
SMILES: O=C1C(=C(O)C=CC=CC)[C@H]2[C@](O)(C)C([C@@]1([C@H](C3=CC=CC=C3)C2)C)=O
Compound: Microginin 299-A
SMILES: ClCCCCCCC[C@H](N)[C@H](O)C(=O)N[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)O)CC2=CC=C(O)C=C2)CCC1)CC3=CC=C(O)C=C3)C)C(C)C)C)C(C)C
Compound: JBIR-88
SMILES: ClC1=C(O)C=2C(=O)C3=C(C4=C(C(O)C5C(C4=O)C5(Cl)Cl)C=C3O)C(C2C=C1)=O
Compound: 3,3,7,7-tetramethyl-1,2,5-trithiepane
SMILES: S1SC(CSCC1(C)C)(C)C
Compound: Microginin KR767
SMILES: O=C(N[C@@H](C(=O)O)CC1=CC=C(O)C=C1)[C@H]2N(C(=O)[C@@H](N(C(=O)[C@H](NC(=O)[C@@H](O)[C@@H](NC)CCCCCCC)CC3=CC=C(O)C=C3)C)CC(C)C)CCC2
Compound: Saturnispol D
SMILES: O=C1C(=C(O)C=CC=CCO)[C@H]2[C@](O)(C)C([C@@]1([C@H](C3=CC=CC=C3)C2)C)=O
Compound: Asperfuran A
SMILES: O=C(OC)C=1OC(/C(=C/CO)/C)=CC1
Compound: Hirsutellone C
SMILES: O=C1[C@]23O[C@H]2[C@](O)(CC4=CC=C(O[C@@H]5[C@@H]6[C@@H]1[C@H](C=C[C@H]6[C@@H]7C[C@H](C)CC[C@@H]57)C=C)C=C4)NC3=O
Compound: LI-F05b
SMILES: O=C1O[C@@H]([C@H](NC(=O)CC(O)CCCCCCCCCCCCN=C(N)N)C(=O)N[C@@H](C(=O)N[C@@H]([C@H](CC)C)C(N[C@@H](C(N[C@@H](C(N[C@@H]1C)=O)CCC(=O)N)=O)[C@H](O)C)=O)C(C)C)C
Compound: Phoxalone
SMILES: O=C1OC(C2=CC=CC=C2)[C@H](O)[C@@H](CC(C)[C@@H]3OC(CC1)(O)C(OC)[C@@H](O)[C@@H]3O)C
Compound: Microginin KR801
SMILES: ClCCCCCCC[C@H](NC)[C@H](O)C(=O)N[C@@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)N[C@@H](C(=O)O)CC2=CC=C(O)C=C2)CCC1)CC(C)C)C)CC3=CC=C(O)C=C3
Compound: Saturnispol E
SMILES: O=C1C(=C(O)[C@](O)(C)C[C@H]1[C@@H](O)/C=C/C=C/CO)C
Compound: Auracin R
SMILES: O=C1C2=C(N(O)C(=C1C/C=C(/C=C/C=C(/CCC=C(C)C)\C)\C)C)C=CC=C2
Compound: Asperergoster A
SMILES: O=C1C=C2C=CC3=C4[C@]([C@@H]([C@@H](/C=C/[C@@H](C(O)(C)C)C)C)C[C@@H]4O)(C)[C@@H](C[C@@H]3[C@@]2(C)CC1)O
Compound: Emericellene E
SMILES: O=C(O)[C@@]1([C@@H]2[C@@H](C=O)CC[C@@H]1CC=C(CCC=C(CC2)C)C)CCC=C(C)C
Compound: Hawaiinolide E
SMILES: O=C1[C@]2(O)[C@@]([C@H]3C[C@H](O)[C@]([C@@H]([C@@H]3C1)C)(O)C=C)(CC[C@H]4[C@@]2(C(=O)O4)C)C
Compound: Saturnispol F
SMILES: O=C1O[C@](CCC(=O)/C=C/C=C/CO)(C)C(=C1C)O
Compound: Microviridin SD-1652
SMILES: O=C1N2[C@H](C(=O)N[C@@H]3C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](CCC(OC3)=O)C(=O)N[C@@H]([C@@H](C(NCCCC[C@@H](C(N[C@H]1CC4=CC=C(O)C=C4)=O)NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)[C@H](O)C)C)[C@H](O)C)CCCNC(=N)N)=O)O)C(=O)N[C@H](C(=O)O)CC5=CC=C(O)C=C5)CC=6C7=C(C=CC=C7)NC6)CC(=O)O)CCC2
Compound: Versicobenzo A
SMILES: O=C1O[C@H](OC)C=2C1=C(O)C(OC)=C(O)C2C
Compound: Microginin KR835
SMILES: ClC(Cl)CCCCCC[C@H](NC)[C@H](O)C(=O)N[C@@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)N[C@@H](C(=O)O)CC2=CC=C(O)C=C2)CCC1)CC(C)C)C)CC3=CC=C(O)C=C3
Compound: Punctaporonin M
SMILES: O=C(O[C@@H]1[C@@]2(O)C(C[C@@H]2[C@]3(C=C[C@@H]([C@]3(C1)C)O)CO)(C)C)C
Compound: Bacillistatin 2
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(=O)N[C@@H](C(=O)O[C@H](C(N[C@H](C(O[C@@H](C(N[C@H](C(O[C@H](C(N[C@H]1C(C)C)=O)C)=O)C(C)C)=O)[C@H](CC)C)=O)C(C)C)=O)C)C(C)C)CC(C)C)C(C)C)C)C(C)C)[C@H](CC)C
Compound: Saturnispol G
SMILES: O=C1OC(=CC(=C1C)O)/C=C/CCCO
Compound: Penidepsidone A
SMILES: O=C1OC2=C(C(=CC(=C2)O)C)OC3=C1C(=CC(=C3C)O)C
Compound: Hirsutellone E
SMILES: O=C1[C@H]2[C@H](C=C[C@@H]3[C@@H]2[C@@H](OC4=CC=C(C[C@]5(C[C@@H]1C(=O)N5)O)C=C4)[C@@H]6CC[C@H](C[C@@H]36)C)/C=C\C
Compound: 1beta,7beta-Dihydroxydehydroabietic acid
SMILES: O=C(O)[C@]1([C@H]2[C@@](C3=C(C=C(C(C)C)C=C3)[C@H](C2)O)([C@H](O)CC1)C)C
Compound: Microginin KR787
SMILES: ClCCCCCCC[C@H](N)[C@H](O)C(=O)N[C@@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)N[C@@H](C(=O)O)CC2=CC=C(O)C=C2)CCC1)CC(C)C)C)CC3=CC=C(O)C=C3
Compound: Cyanopeptolin CP985
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CC5=CC=C(O)C=C5)C
Compound: Carboxymycobactin-1
SMILES: O=C1N(O)CCCCC1NC(=O)C(C(OC(=O)C(NC(=O)C2N=C(C3=C(O)C=CC=C3)OC2C)CCCCN(O)C(=O)/C=C\CCCC(=O)O)CC)C
Compound: Penisclerotiorin A
SMILES: O=C1C(=C(OC)[C@H](OC2=C(C(O)=CC(=C2)C)C)[C@]([C@@H]1O)(OC)C)C
Compound: 5,8,11,14-cis-nonadecatetraenoic acid
SMILES: O=C(O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C
Compound: Versisponic acid D
SMILES: O=C(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)[C@H](C1)OC(=O)C)C)CCC(=C)C(C)C
Compound: Cyanopeptolin CP962
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CCCN=C(N)N)C
Compound: Microginin FR4
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)O)CC1=CC=C(O)C=C1)CC2=CC=C(O)C=C2)[C@H]3N(C(=O)C(NC(=O)[C@@H](O)[C@H](NC)CCCCCCC)[C@@H](O)C)CCC3
Compound: Laxaphycin D
SMILES: O=C1N([C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N2[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](CC(N[C@H](C(N[C@@H](C(N[C@H](C(N[C@@H](C(N[C@@H]1CCC(=O)N)=O)[C@@H](O)C(C)C)=O)C)=O)[C@@H](O)C(C)C)=O)C(C)C)=O)CCCCC)[C@H](O)C)CC(C)C)CCC2)[C@H](O)C)[C@@H](O)C(=O)N)C(CC)C)C
Compound: Diaporthein C
SMILES: O=C1C2=C([C@]34CCCC([C@@]4([C@]1(OC3)O)O)(C)C)[C@H](O)C[C@@](C2)(C=C)C
Compound: 5alpha-lanosta-7,9(11),24-triene-15alpha,26-dihydroxy-3-one
SMILES: O=C1C([C@H]2[C@](C=3C([C@]4([C@]([C@@H]([C@@H](CC/C=C(/CO)\C)C)C[C@@H]4O)(C)CC3)C)=CC2)(C)CC1)(C)C
Compound: Cyanosporaside D
SMILES: ClC1=C2C(=CC(=C1)CC#N)[C@@]3(O)[C@@H](OC(=O)C)C=CC3=C2
Compound: 4-[2-O-11Z-octadecenoyl-beta-glucopyranosyl]-4,4′-diapolycopene-4,4′-dioic acid
SMILES: O=C(OC1OC(C(O)C(C1OC(=O)CCCCCCCCCC=CCCCCCC)O)CO)C(=CC=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC=C(C(=O)O)C)C)C)C)C)C
Compound: Cyanopeptolin CP1049
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCCCCCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CCC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CCCCC(=N)N)C
Compound: Microginin FR3
SMILES: O=C(N[C@H](C(=O)N[C@@H](C(=O)O)CC1=CC=C(O)C=C1)CC2=CC=C(O)C=C2)[C@@H]3N(C(=O)[C@H](NC(=O)[C@H](O)[C@@H](N)CCCCCCC)[C@H](O)C)CCC3
Compound: Monaxanthone A
SMILES: O=C1C2=C(OC3=C1C(=CC(=C3)O)C)C=C(O)C=C2CC(=O)C[C@H](O)C
Compound: Cavinafungin B
SMILES: O=C(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C=O)C)CCO)C(C)C)[C@H]1N(C(=O)[C@@H](NC(=O)CCCCCCC/C=C\CCCCCCCC)[C@H](O)C)C[C@@H](C1)C
Compound: Sclerotionigrin B
SMILES: O=C1O[C@]23C(=O)N[C@@H]([C@@H]2C(C)=C([C@H]([C@H]3C=CC[C@@H](C)CCCCC=C1)O)C)CC4=CC=CC=C4
Compound: Cyanopeptolin CP1018
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCCCCCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CC3=CC=CC=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CCCCC(=N)N)C
Compound: Cryptophycin F
SMILES: ClC1=C(OC)C=CC(=C1)C[C@H](NC(=O)/C=C/C[C@H](O)[C@@H]([C@@H](O)[C@@H](O)C2=CC=CC=C2)C)C(=O)NC[C@H](C(=O)OC)C
Compound: Monaxanthone B
SMILES: O=C1C2=C(OC3=C1C(=CC(=C3)O)CC(=O)C)C=C(O)C=C2CC(=O)C[C@H](O)C
Compound: Parnafungin B2
SMILES: O=C1C2=C(O)C3=C(C=4C5=C6N(OC(C6=CC=C5)=O)CC4C=C3O)O[C@@]2(C(=O)OC)[C@@H](O)CC1
Compound: Microginin KR604
SMILES: O=C(O)[C@H]1N(C(=O)[C@@H](N(C(=O)[C@H](NC(=O)[C@@H](O)[C@@H](NC)CCCCCCC)CC2=CC=C(O)C=C2)C)CC(C)C)CCC1
Compound: Arecolactone
SMILES: O=C1O[C@@H]2CC3=CCC[C@@H]([C@]3(C[C@@]2(C1=C)O)C)C
Compound: Cyanopeptolin CP992
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CCC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CCCCC(=N)N)C
Compound: Neomaclafungin B
SMILES: O=C1O[C@@H]2[C@@H]([C@@H](O[C@]3(C2)O[C@H]([C@@H](C)CC3)C[C@H](O)C)CC[C@H](C=CC=CCC[C@H]([C@H]([C@H](C[C@H](C[C@H]([C@@H]([C@@H]([C@H](C=C1)C)O)C)O)OC)O)C)O)CC)CCC(O)C
Compound: Microginin KR638
SMILES: ClCCCCCCC[C@H](NC)[C@H](O)C(=O)N[C@@H](C(=O)N([C@H](C(=O)N1[C@H](C(=O)O)CCC1)CC(C)C)C)CC2=CC=C(O)C=C2
Compound: Monaphenol A
SMILES: O=C(C1=C(O)C=C(O)C=C1CC(=O)C[C@H](O)C)C2=C(O)C=C(O)C=C2C
Compound: Carbazoquinocin F
SMILES: O=C1C(=O)C2=C(NC3=C2C=CC=C3)C(=C1C)CCCCCCC(C)C
Compound: Termitomycamide B
SMILES: O=C(NCC(=O)C=1C2=C(C=CC=C2)NC1)CCCCCCC/C=C\C/C=C\CCCCC
Compound: Cyanopeptolin CP990
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCCCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CC3=CC=CC=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CCCN=C(N)N)C
Compound: Palmarumycin CE1
SMILES: O=C1C=CC2(OC=3C=4C(C=CC3)=CC=CC4O2)[C@H]5[C@@H]1[C@@H](O)CC[C@H]5O
Compound: Almiramide F
SMILES: O=C(N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N)CO)[C@@H](CC)C)C)[C@@H](CC)C)C(C)C)C)[C@@H](N(C(=O)[C@@H](CCCCC#C)C)C)C(C)C
Compound: Achaetolide-II
SMILES: O=C1O[C@@H](C[C@H](O)[C@H](O)C=C[C@H](C1)OC(=O)[C@H]([C@@H](O)C)C)CCCCCCC
Compound: Monathioamide A
SMILES: S(C(=O)[C@H](NC(=O)C)C)/C=C/1\NC(=O)C=CC(=C1)CCC
Compound: Cyanopeptolin CP978
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CCCCC(=N)N)C
Compound: Loloatin C
SMILES: O=C1N2[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H]1CC3=CC=C(O)C=C3)=O)CC(C)C)=O)CCCN)=O)C(C)C)=O)CC=4C5=C(C=CC=C5)NC4)CC(=O)O)CC(=O)N)CC6=CC=CC=C6)CC=7C8=C(C=CC=C8)NC7)CCC2
Compound: Gilvocarcin HE
SMILES: O=C1OC=2C=3C(C(OC)=CC2C4=C1C=C([C@@H](O)C)C=C4OC)=C(O)C=CC3[C@H]5O[C@@H]([C@@H](O)C)[C@@H]([C@H]5O)O
Compound: Almiramide D
SMILES: O=C(N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N)C)[C@@H](CC)C)C)[C@@H](CC)C)C(C)C)C)[C@@H](N(C(=O)[C@@H](CCCCC#C)C)C)C(C)C
Compound: Diapolycopenedioic acid xylosyl ester B
SMILES: O=C(O[C@@H]1OC[C@@H](O)[C@H](C1OC(=O)CCCCCCCCCCC(CC)C)O)/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/C(=O)O)\C)\C)\C)/C)/C)/C
Compound: Alternarizine A
SMILES: O=C1N([C@H](C(=O)N[C@H]1CC2=CC=C(OCC=C(C)C)C=C2)CC3=CC=CC=C3)C
Compound: Cyanopeptolin CP1027
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCCCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CCC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CC5=CC=C(O)C=C5)C
Compound: Monaprenylindole A
SMILES: O=C(O)CC=1C2=C(C=C(CC=C(C)C)C=C2)NC1
Compound: Tripropeptin aiC
SMILES: O=C1O[C@@H](CC(=O)N[C@@H](C(=O)N2[C@@H](C(=O)N3[C@H](C(=O)N[C@H](C(N[C@@H](C(N[C@H](C(N4[C@H](C(N[C@H]1[C@H](O)C(=O)O)=O)[C@@H](O)CC4)=O)CO)=O)[C@@H](O)C(=O)O)=O)CCCN=C(N)N)CCC3)CCC2)[C@H](O)C)CCCCCCCCC(CC)C
Compound: Almiramide E
SMILES: O=C(N([C@H](C(=O)N[C@H](C(=O)N)C)[C@@H](CC)C)C)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](N(C(=O)[C@@H](CCCCC#C)C)C)C(C)C)C(C)C)[C@@H](CC)C
Compound: Cyanopeptolin CP1013
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCCCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CC5=CC=C(O)C=C5)C
Compound: Monavalerolactone
SMILES: O=C/1O[C@H](C)C\C1=C\C2=C(O)C=C(O)C=C2C
Compound: Acarviostatin II13
SMILES: O=C[C@H](O)[C@@H](O)[C@H](O[C@H]1O[C@@H]([C@@H](O[C@H]2O[C@@H]([C@@H](O[C@H]3O[C@@H]([C@@H](O[C@H]4O[C@@H]([C@@H](N[C@H]5C=C([C@@H](O[C@H]6O[C@@H]([C@@H](O[C@H]7O[C@@H]([C@@H](N[C@H]8C=C([C@@H](O[C@H]9O[C@@H]([C@@H](O)[C@@H]([C@H]9O)O)CO)[C@@H]([C@H]8O)O)CO)[C@@H]([C@H]7O)O)C)[C@@H]([C@H]6O)O)CO)[C@@H]([C@H]5O)O)CO)[C@@H]([C@H]4O)O)C)[C@@H]([C@H]3O)O)CO)[C@@H]([C@H]2O)O)CO)[C@@H]([C@H]1O)O)CO)[C@H](O)CO
Compound: Brevione I
SMILES: O=C1OC(=C(C)C2=C1C[C@@]3(C(=C[C@H](O)[C@H]4[C@]3(CC[C@@H]5[C@@]4(C=CC(=O)C5(C)C)C)C)C)O2)C
Compound: Almiramide G
SMILES: O=C(N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N)C)[C@@H](CC)C)C)C(C)C)C(C)C)C)[C@@H](N(C(=O)[C@@H](CCCCC#C)C)C)C(C)C
Compound: 5aTHQ-8i
SMILES: N1C2=C(C(=CC=C2)CCCCCC(C)C)CCC1
Compound: 3,4,7-trihydroxy-6-methylcoumarin
SMILES: O=C1OC2=C(C=C(C)C(=C2)O)C(=C1O)O
Compound: Cyanopeptolin CP999
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CCC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CC5=CC=C(O)C=C5)C
Compound: Thelephantin G
SMILES: O=C(OC1=C(O)C(=C(OC(=O)C2=CC=C(O)C=C2)C(=C1C3=CC=C(O)C=C3)O)C4=CC=C(O)C=C4)C5=CC=C(O)C=C5
Compound: Almiramide H
SMILES: O=C(N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)NCC(=O)N)[C@@H](CC)C)C)[C@@H](CC)C)C(C)C)C)[C@@H](N(C(=O)[C@@H](CCCCC#C)C)C)C(C)C
Compound: 4-(3-methyl-2-butenyl) oxy 1-phenyl acetic acid
SMILES: O=C(O)CC1=CC=C(OCC=C(C)C)C=C1
Compound: Etamycin VI-2
SMILES: O=C1OC(C(NC(=O)C2=NC=CC=C2O)C(=O)NC(C(=O)N3C(C(=O)N(C)CC(NC(C(NC(C(N(C1C4=CC=CC=C4)C)=O)C)=O)C(C(C)C)C)=O)C[C@H](C3)O)C(CC)C)C
Compound: Blazeispirol V
SMILES: O=C1C=C2[C@](C3=C([C@]45O[C@@]6(OC(C)(C)[C@H]([C@H]6O)C)[C@@H](C)[C@H]([C@@]4(C)C=C3)CC5)[C@@H]([C@@H]2O)O)(C)CC1
Compound: Laricinin A
SMILES: O=C1N[C@@H](CC(C)C)[C@@H]([C@H]1[C@@H]2O[C@@H](CC=C2)C)O
Compound: Ypaoamide A
SMILES: O=C1N(C(=O)/C=C(/OC)\CCNC(=O)CCCCC(C)(C)C)[C@@H](CC2=CC=C(O)C=C2)C=C1
Compound: Cyanopeptolin CP969
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CC3=CC=CC=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CC5=CC=C(O)C=C5)C
Compound: Asterriquinone D
SMILES: O=C1C(OC)=C(C(=O)C(=C1C=2C3=C(C=CC=C3)NC2)OC)C=4C5=C(C=CC=C5)NC4
Compound: Mooreaside A
SMILES: O=C(N[C@H]([C@H](O)C/C=C/CCCCCCCCCCC)CO[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@H]1O)O)CO)CCCCCCCCCCCCCCCCCCCCCCCC
Compound: Milbemycin alpha30
SMILES: O=C1O[C@@H]2C[C@]3(O[C@@H](C2)CC=C(C[C@H](C=CC=C4[C@]5([C@H]1C=C([C@@H](O)[C@H]5OC4)C)O)C)C)O[C@@H]([C@@H](C)[C@@H]([C@H]3O)OC(=O)C(CC)C)CC
Compound: Tricycloalternarene X
SMILES: O=C1C2=C(O[C@]3(C[C@H](C(=C3C2)C(CCCC(COC(=O)C)C)C)O)C)CC[C@@H]1O
Compound: CG-1-C
SMILES: O=C1C2=C(O)C3=C([C@@H](C(=O)OC)[C@@](O)(CC)C[C@@H]3OC4OC(C(OC5OC(C(OC6OC(C(=O)C=C6N)C)C(C5)O)C)C(C4)N(C)C)C)C=C2C(=O)C=7C1=C(O)C=CC7
Compound: Ent-astropaquinone C
SMILES: O=C1C2=C(OC)C=C(OC)C=C2C(=O)C3=C1[C@H](O[C@@H](C3)C)O
Compound: Cyanopeptolin CP1020
SMILES: O=C1OC(C(NC(=O)C(NC(=O)CCCCC)CC(=O)O)C(=O)NC(C(=O)NC2CCC(N(C(C(N(C(C(NC1C(C)C)=O)CCC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C2=O)O)CCCCC(=N)N)C
Compound: 3-acetyl-2′-deoxyuridine
SMILES: O=C1N(C(=O)C=CN1[C@@H]2O[C@H](CO)[C@H](C2)O)C(=O)C
Compound: Virescenoside Z4
SMILES: O=C1[C@@]([C@H]2[C@]([C@@H]3C(C[C@](C=C)(C)CC3)=CC2)(C)CC1)(CO[C@@H]4O[C@H](C(=O)O)[C@@H](O)[C@H]([C@@H]4O)O)C
Compound: Psychrophilin C
SMILES: O=[N+]([O-])[C@@H]1C(=O)N[C@H](C(=O)NC=2C=CC=CC2C(N3C=C(C1)C4=C3C=CC=C4)=O)C
Compound: Tricycloalternarene Y
SMILES: O=C1C2=C(O[C@@]3(C[C@@H](O[C@@H]3C2)/C=C(/CCC=C(C)C)\C)C)CC[C@H]1O
Compound: Sorbicillasin A
SMILES: O=C1N[C@@]2(N(C(=O)C=3C2=C(O)C(=C(O)C3C)C)[C@@H](C1)C(=O)O)CCC=CC
Compound: 3-phenylethyl-2′-deoxyuridine
SMILES: O=C1N(C=CC(N1CCC2=CC=CC=C2)=O)[C@@H]3O[C@H](CO)[C@H](C3)O
Compound: 8-methoxy-3,5-dimethylisoquinolin-6-ol
SMILES: O(C=1C=2C(C(C)=C(C1)O)=CC(C)=NC2)C
Compound: 22xi-acetoxy-3beta,23xi-dihydroxy-24-methylenelanost-8-ene
SMILES: O=C(O[C@H]([C@H](O)C(=C)C(C)C)[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@@H](O)CC4)(C)C)CC3)C)CC2)(C)CC1)C)C)C
Compound: 4'-O-methyl-beta-D-benzylglucoside
SMILES: O1[C@@H](OCC2=CC=CC=C2)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)OC
Compound: 8-O-beta-D-gentiobioside of xanthorin 1-O-methyl ether
SMILES: O=C1C2=C(C(=O)C=3C1=C(OC)C=C(C)C3)C(O)=C(OC)C=C2O[C@@H]4O[C@@H]([C@@H](O)[C@@H]([C@H]4O)O)CO[C@@H]5O[C@@H]([C@@H](O)[C@@H]([C@H]5O)O)CO
Compound: Sorbicillasin B
SMILES: O=C1N[C@]2(N(C(=O)C=3C2=C(O)C(=C(O)C3C)C)[C@@H](C1)C(=O)O)CCC=CC
Compound: [Gly1,D-Asp3,Dhb7]MC-LR
SMILES: O=C/1NCC(=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(N\C1=C/C)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)/C)=O)CC(C)C
Compound: Berninamycin D
SMILES: S1C2=NC(=C1)C(=O)N[C@H](C(=O)N/C(/C=3OC(C)=C(N3)C(=O)NC(C(=O)N[C@@H](C(O)(C)C)C(NC(C4=NC(C(NC(C(NC(C5=NC(C6=C2C=CC(=N6)C(=O)N)=CO5)=C)=O)=C)=O)=C(O4)C)=C)=O)=C)=C\C)[C@H](O)C
Compound: Pyrroindomycin A
SMILES: O=C1NC23C(C(C(=O)O)=CC(C2)(CC(CC)C(CC4C(C(=C1C3=O)O)(C5C(C(O[C@H]6O[C@H]([C@@H](O[C@@H]7O[C@@H]([C@@H](O[C@@H]8O[C@@H]([C@H](N)[C@@H](C8)OC(=O)C=9NC=%10NC=%11C=CC=CC%11C%10C9)C)[C@](C7)(O)C)C)CC6)C)CCC5)C=C4)C)O)C)C
Compound: Scirpyrone K
SMILES: O=C1OC(=CC(=C1C)O)CCC(=O)OC
Compound: Microsphaerophthalide E
SMILES: O=C1O[C@H](OCC)C=2C1=C(OC)C(=C(O)C2COCC)C
Compound: Ascherlactone A
SMILES: O=C1C2=C(O[C@@](C1)([C@H]3OC(=O)C[C@@H]3OC)C)C=C(C)C=C2O
Compound: [Gly1,D-Asp3,Dhb7]MC-LHar
SMILES: O=C/1NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)O)CC(=O)N[C@@H](CCCCN=C(N)N)C(N[C@H]([C@@H](C(N[C@H](CCC(N\C1=C/C)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)/C)=O)CC(C)C
Compound: Lavendustin B
SMILES: O=C(O)C1=C(O)C=CC(=C1)N(CC2=C(O)C=CC=C2)CC3=C(O)C=CC=C3
Compound: Ascherlactone B
SMILES: O=C1C2=C(O[C@@](C1)([C@H]3OC(=O)C[C@@H]3OC)C)C=C(C)C=C2OC
Compound: Trienomycin H
SMILES: O=C1NC2=CC(O)=CC(=C2)CCC=C([C@H](O)[C@@H](C)[C@H](CC=CC=CC=C[C@@H](C1)OC)OC(=O)[C@@H](NC(=O)C)C)C
Compound: Trichorzin HA-2
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)(CC)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(N)(C)C)C)(C)C)(C)C)CCC(=O)N)(C)C)C(C)C)(C)C)CC(C)C)(C)C
Compound: Pyralomicin 2b
SMILES: ClC1=C2OC=3N(C(Cl)=CC3C(C2=C(O)C(=C1)C)=O)[C@@H]4O[C@@H]([C@@H](OC)[C@@H]([C@H]4O)O)CO
Compound: [Gly1,D-Asp3,ADMAdda5,Dhb7]MC-LR
SMILES: O=C/1NCC(=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(N\C1=C/C)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC(=O)C)CC2=CC=CC=C2)C)/C)=O)CC(C)C
Compound: Sansalvamide A
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=CC=C2)=O)CC(C)C)=O)CC(C)C)CC(C)C)CC(C)C
Compound: Trienomycin I
SMILES: O=C1NC2=CC(O)=CC(=C2)CCC=C([C@H](O)[C@@H](C)[C@H](CC=CC=CC=C[C@@H](C1)OC)OC(=O)C)C
Compound: Gageopeptide C
SMILES: O=C(O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C[C@H](O)CCCCC(CC(CC)C)C)CC(C)C)CCC(=O)O)CC(C)C)CC(C)C
Compound: Fusaraisochromenone
SMILES: O=C1C2=C(C[C@H]([C@]1(O)C)O)CC(C)OC2
Compound: [Gly1,D-Asp3,ADMAdda5,Dhb7]MC-LHar
SMILES: O=C/1NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)O)CC(=O)N[C@@H](CCCCN=C(N)N)C(N[C@H]([C@@H](C(N[C@H](CCC(N\C1=C/C)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC(=O)C)CC2=CC=CC=C2)C)/C)=O)CC(C)C
Compound: Ascherchromanone A
SMILES: O=C1C2=C(O[C@]3([C@@]1(O)[C@@H](O)C=C([C@@H]3OC(=O)C)OC)C)C=C(C)C=C2O
Compound: GGL 2
SMILES: O1C(O[C@@H]2[C@H](O)[C@H](O[C@@H]([C@H]2O)CO)OCC(O)COCCCCCCCCCCCC(CC)C)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)O
Compound: Altertoxin VII
SMILES: O=C1C=2C=3C(=C4C=5C(=CC(=C4)O)[C@H](O)CCC5C3CC1)C=CC2O
Compound: Ustilipid F2
SMILES: O=C(O[C@@H]1[C@H](OC(=O)CC)[C@@H](O[C@@H]([C@H]1OC(=O)C)CO)OC[C@@H](O)[C@@H](O)CO)CCCCCCCCCCCCC
Compound: Phenethyl 4'-O-methylglucoside
SMILES: O1[C@@H](OCCC2=CC=CC=C2)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)OC
Compound: [Gly1,D-Asp3,Dhb7]MC-RR
SMILES: O=C1NCC(=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)CC2=CC=CC=C2)C)/C)=O)CCCN=C(N)N
Compound: Cochlearoid C
SMILES: O=C(OC)[C@@]12OC3=C4C(=C(O)C=C3)C=5C=C(O)C=C(C5O[C@]4(C1)[C@H](C(=C)C)CC2)C/C=C(/CC/C=C(/CCC=C(C)C)\C)\C
Compound: Sporovexin B
SMILES: O=C(O)C1=CC=C(OCC(O)C(C(=O)O)C)C=C1
Compound: Butyl xanalterate
SMILES: O=C1C=2C=3C(=C4C=5C(O[C@](CC5C3CC1)(O)C(=O)OCCCC)=C(O)C=C4)C=CC2O
Compound: 5-chloro-6-hydroxymellein
SMILES: ClC1=C(O)C=C(O)C2=C1C[C@@H](C)OC2=O
Compound: 4'-O-methylpleoside
SMILES: O=C(C1=C(O[C@@H]2O[C@@H]([C@@H](OC)[C@@H]([C@H]2O)O)CO)C=C(OC)C=C1O)C
Compound: [Gly1,D-Asp3,Dhb7]MC-Rhar
SMILES: O=C1NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)O)CC(=O)N[C@@H](CCCCN=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)CC2=CC=CC=C2)C)/C)=O)CCCN=C(N)N
Compound: Cytochalasin Y
SMILES: O=C1[C@@]23C(=O)NC([C@@H]2C(C)=C([C@H]([C@@H]3C=CC[C@@H](C[C@H]([C@@H](C1)O)O)C)O)C)CC=4C5=C(C=CC=C5)NC4
Compound: Solwaric acid B
SMILES: O=C(O)CCCCCCCC1=C(C=C(C)C=C1)/C=C\C
Compound: Nordihydroaltenuene A
SMILES: O=C1O[C@@]2([C@@H]([C@@H](O)[C@H](C2)O)C=3C1=C(O)C=C(OC)C3)C
Compound: 4-Hydroxyphenethyl 2-(4-hydroxyphenyl)acetate
SMILES: O=C(OCCC1=CC=C(O)C=C1)CC2=CC=C(O)C=C2
Compound: 4'-O-methyltorachrysone 8-O-glucoside
SMILES: O=C(C1=C(O)C2=C(O[C@@H]3O[C@@H]([C@@H](OC)[C@@H]([C@H]3O)O)CO)C=C(OC)C=C2C=C1C)C
Compound: Verlamelin B
SMILES: O=C1O[C@H](CCCC(=O)N[C@@H](C(=O)N[C@@H](C(=O)N2[C@H](C(N[C@H](C(N[C@@H](C(N[C@H]1C(C)C)=O)CC3=CC=C(O)C=C3)=O)CCC(=O)N)=O)CCC2)C)CO)CCCCCCCCC
Compound: [Gly1,D-Asp3,ADMAdda5,Dhb7]MC-RR
SMILES: O=C1NCC(=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)CCCN=C(N)N
Compound: Saccharothrixone C
SMILES: O=C1C=C(OC)[C@@H](O)[C@]([C@@H]1OC)(O)[C@@H]2OC(=O)C=3C2=CC4=CC(OC)=C(C(=C4C3O)C)C(=O)OC
Compound: Aspergiolide B
SMILES: O=C1OC2=C3C(C(=O)C4=C(C3=C1C(=O)C5=C(O)C=C(O)C=C5C)C=C(O)C=C4OC)=C(O)C=C2C
Compound: (S)-isoochracinate A1
SMILES: O=C1O[C@@H](CC(=O)OC)C=2C1=C(O)C=CC2
Compound: Diaporthichalasin D
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14[C@H](O)C=C[C@H](C[C@H](CC=C[C@H]4[C@H](O)C(C)=C3C)C)C
Compound: Trichorovin-IVb
SMILES: O=C(N1C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N2C(C(=O)NC(C(C)C)CO)CCC2)(C)C)CC(C)C)CC(C)C)CCC1)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C)(C)C)CCC(=O)N)CC(C)C)C(C)C)(C)C
Compound: [Gly1,D-Asp3,ADMAdda5,Dhb7]MC-RHar
SMILES: O=C1NCC(=O)N[C@H](C(=O)N[C@@H](C(=O)O)CC(=O)N[C@@H](CCCCN=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)CCCN=C(N)N
Compound: (Z)-3-Ethylidene-1,3-dihydroindol-2-one
SMILES: O=C/1NC=2C=CC=CC2\C1=C\C
Compound: Roimatacene
SMILES: O=C(O)/C=C/CC(O)/C=C/C(=C/C=C/C=C/CC(O)C(O)(C(O)CC(O)/C(=C/C=C/C=C/CC)/C)C)/C
Compound: (R)-isoochracinate A2
SMILES: O=C1O[C@H](CC(=O)OC)C=2C1=C(O)C=CC2
Compound: Diaporthichalasin E
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14[C@H](O)C=C[C@H]([C@H](O)[C@H](CC=C[C@H]4[C@H](O)C(=C)[C@H]3C)C)C
Compound: Fuscopeptin A
SMILES: O=C1OC(C(NC(=O)/C(/NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C2N(C(=O)/C(/NC(=O)CC(O)CCCCC)=C\C)CCC2)CC(C)C)C)C)C)C)C(C)C)C)C(C)C)C)C(C)C)=C/C)C(=O)NC(C(=O)NC(C(NC(C(NC1CC3=CC=CC=C3)=O)C(N)C)=O)C(N)C)C)C
Compound: Penicolinate E
SMILES: O=C(OC)C1=NC=C(CCCCCCCCCCC(=O)C)C=C1
Compound: [D-Asp3]MC-RHar
SMILES: O=C1N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)CC(=O)N[C@@H](CCCCN=C(N)N)C(N[C@H]([C@@H](C(N[C@H](CCC(N(C1=C)C)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)/C)=O)CCCN=C(N)N)C
Compound: (S)-alternariphent A
SMILES: O=C1C(C2=CC(OC)=CC(=C2)O)=C(C)C[C@@H]1O
Compound: Mannopeptimycin beta
SMILES: O=C1N[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(N[C@@H](C(NC1[C@@H](O)[C@H]2NC(N)=NC2)=O)CC3=CC=C(O)C=C3)=O)[C@H](C4=CC=CC=C4)C)CO)[C@@H](O)[C@H]5N(C(N)=NC5)[C@H]6O[C@@H]([C@@H](O)[C@@H]([C@@H]6O)O)CO
Compound: Diaporthichalasin F
SMILES: O=C1N[C@@H](CC2=CC=CC=C2)[C@H]3[C@@]14[C@H](O)C=C[C@H](C[C@@](CC=C[C@H]4[C@H](O)C(=C)[C@H]3C)(O)C)C
Compound: Daidzein G3
SMILES: O=C1C(C2=CC=C(O)C=C2)=COC3=C1C=CC(=C3)OC4O[C@H]([C@H](O)[C@H]([C@H]4OC)O)C
Compound: [D-Leu1,L-Ser7]MC-HtyR
SMILES: O=C1N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O)[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(N[C@H]([C@@H](C(N[C@H](CCC(N[C@H]1CO)=O)C(=O)O)=O)C)/C=C/C(=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)/C)=O)C)CCC3=CC=C(O)C=C3)CC(C)C
Compound: Syringolin F
SMILES: O=C1NCCC=CC(NC(=O)C(NC(=O)NC(C(=O)O)C(CC)C)C(CC)C)C(NC(C=C1)C(C)C)=O
Compound: (R)-alternariphent A
SMILES: O=C1C(C2=CC(OC)=CC(=C2)O)=C(C)C[C@H]1O
Compound: L-altrarate(1-)
SMILES: [H+].O[C@@H]([C@@H](O)[C@@H](O)C([O-])=O)[C@@H](O)C([O-])=O
Compound: Orirubenone F
SMILES: O=C(C1=C(O)C=CC(=C1)O)/C=C(\CCC(=O)OC)/C
Compound: (1S,2R)-3-oxo-2-pentylcyclopentane-1-octanoic acid methyl ester
SMILES: O=C1[C@@H]([C@@H](CCCCCCCC(=O)OC)CC1)CCCCC
Compound: Diaporthichalasin G
SMILES: O=C1N[C@@H](CC2=CC=C(O)C=C2)[C@H]3[C@@]14[C@H](O)C=C[C@H](C[C@H](CC=C[C@H]4C=C(CO)[C@H]3C)C)C
Compound: AP731
SMILES: O=C1N(CC(=O)N[C@H](C(=O)NCCCC[C@H](C(N[C@H](C(N[C@H]1CC(C)C)=O)C(C)C)=O)NC(=O)N[C@@H](C(=O)O)CC2=CC=CC=C2)COC(=O)C)C
Compound: Terremide A
SMILES: O=C(OC)C1=C(NC(=O)C2=C(NC(=O)C3=CN=CC=C3)C=CC=C2)C(O)=CC=C1
Compound: Bisabolan-1,10,11-triol
SMILES: OC([C@@H](O)CC[C@H]([C@@H]1[C@@H](O)C[C@@H](C)CC1)C)(C)C