MonarchInit/C3PO huggingface dataset:
Compound: epi-Ivermectin B1a
SMILES: O=C1OC2CC3(OC(C(C)CC3)C(CC)C)OC(C2)CC=C(C(OC4OC(C(OC5OC(C(O)C(C5)OC)C)C(C4)OC)C)C(C=CC=C6C7(C1C=C(C(O)C7OC6)C)O)C)C
Compound: Delta-2-Ivermectin B1a
SMILES: O=C1OC2CC3(OC(C(C)CC3)C(CC)C)OC(C2)CC=C(C(OC4OC(C(OC5OC(C(O)C(C5)OC)C)C(C4)OC)C)C(C=CC=C6C7(C1=CC(C(O)C7OC6)C)O)C)C
Compound: Ansamitocin P 3'
SMILES: ClC1=C(OC)C=C2CC(=CC=CC(OC)C3(O)NC(OC(C(C4C(C(CC(N(C1=C2)C)=O)OC(=O)CCC)(O4)C)C)C3)=O)C
Compound: Lexithromycin
SMILES: O=C1OC(C(O)(C(O)C(C(=NOC)C(C)CC(C(C(C(C1C)OC2OC(C(O)C(C2)(OC)C)C)C)OC3OC(CC(C3O)N(C)C)C)(O)C)C)C)CC
Compound: L 156602
SMILES: O=C1OC(C(NC(=O)C(O)(C2(OC(C(CC(CC)C)CC2)C)O)C)C(=O)N3NCCCC3C(=O)N(O)C(C)C(NCC(N4C(C(N(C1C)O)=O)CCCN4)=O)=O)C(C)C
Compound: Moniliformin potassium salt
SMILES: [K+].O=C1C([O-])=CC1=O
Compound: Monazomycin
SMILES: O=C1OC(C(C(O)CC(O)CC(O)C(C(O)C(C(O)CC(O)CCC(C(O)C(C=CC(O)CC(O)C(C(C(C=C(C(C(C=C(C(C(C=CCCC(C(C(CCCCC1)O)C)O)C)O)C)C)O)C)OC2OC(C(O)C(C2O)O)CO)O)C)C)C)C)C)C)C(CCCCCCN)C
Compound: Nargenicin
SMILES: O=C1OC(C(C=C(C)C23C(CC1OC)C=CC4C2C(O)C(C)C(C4O3)OC(=O)C=5NC=CC5)C)C(O)C
Compound: Nodusmicin
SMILES: O=C1OC(C(C=C(C)C23C(CC1OC)C=CC4C2C(O)C(C)C(C4O3)O)C)C(O)C
Compound: Narasin sodium
SMILES: [Na+].O=C([O-])C(C1OC(C(C)CC1C)C(C(O)C(C(=O)C(C2OC3(OC4(OC(C5OC(C(O)(CC)CC5)C)(C)CC4)C(O)C=C3)C(C)CC2C)CC)C)C)CC
Compound: Quinolactacin A
SMILES: O=C1C2=C(N(C)C3=C1C(=O)NC3C(CC)C)C=CC=C2
Compound: RK-682 calcium salt
SMILES: [Ca+2].O=C1OC(CO)C(=C1C(=O)CCCCCCCCCCCCCCC)[O-].O=C1OC(CO)C(=C1C(=O)CCCCCCCCCCCCCCC)[O-]
Compound: Spinosyn A 17-pseudoaglycone
SMILES: O=C1C2=CC3C4C(CC(C4)OC5OC(C(OC)C(C5OC)OC)C)C=CC3C2CC(=O)OC(CC)CCCC(C1C)O
Compound: Spinosyn D 17-pseudoaglycone
SMILES: O=C1C2=CC3C4C(CC(C4)OC5OC(C(OC)C(C5OC)OC)C)C(=CC3C2CC(=O)OC(CC)CCCC(C1C)O)C
Compound: Spinosyn A aglycone
SMILES: O=C1C2=CC3C4C(CC(C4)O)C=CC3C2CC(=O)OC(CC)CCCC(C1C)O
Compound: Spinosyn D aglycone
SMILES: O=C1C2=CC3C4C(CC(C4)O)C(=CC3C2CC(=O)OC(CC)CCCC(C1C)O)C
Compound: Sporidesmolide I
SMILES: O=C1OC(C(=O)NC(C(=O)NC(C(=O)OC(C(NC(C(N(C1CC(C)C)C)=O)C(C)C)=O)C(C)C)CC(C)C)C(C)C)C(C)C
Compound: Sporidesmolide II
SMILES: O=C1OC(C(=O)NC(C(=O)NC(C(=O)OC(C(NC(C(N(C1CC(C)C)C)=O)C(C)C)=O)C(C)C)CC(C)C)C(CC)C)C(C)C
Compound: Sporidesmolide-III
SMILES: O=C1OC(C(=O)NC(C(=O)NC(C(=O)OC(C(NC(C(NC1CC(C)C)=O)C(C)C)=O)C(C)C)CC(C)C)C(C)C)C(C)C
Compound: TS 155-2
SMILES: O=C1OC(C(OC)C=CC=C(CC(C(C(C=C(C=C1C)C)C)O)C)C)C(C(O)C(C2(OC(C(C)C(C2)OC(=O)C=CC(=O)O)C(C)C)O)C)C
Compound: Teichomycin A2-5
SMILES: ClC1=C2OC3=C(OC4OC(C(O)C(C4NC(=O)CCCCCCCC(C)C)O)CO)C=5OC6=C(Cl)C=C(CC7NC(=O)C(N)C=8C=CC(=C(OC=9C=C(C(C(NC(C(=C3)C5)C(=O)NC%10C(NC(C(C(=C1)C=C2)OC%11OC(C(O)C(C%11NC(=O)C)O)CO)C(=O)NC(C%12=C(C(OC%13OC(C(O)C(C%13O)O)CO)=CC(=C%12)O)C=%14C=C%10C=CC%14O)C(=O)O)=O)=O)NC7=O)C=C(O)C9)C8)O)C=C6
Compound: Acremin F
SMILES: OC1(C(O)C=C(C=CC(O)(C)C)C(C1)O)C
Compound: Terremide C
SMILES: O=C1N(C(=NC2=C1C=CC=C2)C3=CN=CC=C3)C4=C(OC)C(OC)=C(OC)C=C4C(=O)OC
Compound: Rugulosin ((+) form)
SMILES: O=C1C2=C(C(O)=C3C14C5C(=O)C6=C(O)C=7C(O)=CC(=CC7C(C86C(C4C(O)C8C3=O)C5O)=O)C)C(O)=CC(=C2)C
Compound: 10'-Desmethoxystreptonigrin
SMILES: O=C1C(N)=C(OC)C(=O)C=2C1=NC(C3=NC(=C(C)C(=C3N)C4=C(O)C(OC)=CC=C4)C(=O)O)=CC2
Compound: Acarenoic acid
SMILES: O=C1O[C@H](C[C@H](C1=C)C(=O)O)CCCCCCCCCC
Compound: Chlorothricin
SMILES: ClC1=C(C(=C(OC)C=C1)C(=O)OC2C(O)C(OC(C2)OC3C(O)CC(OC4C5C=CC6CCCCC=CC7C8(C(=C(OC(C6(C5CCC4)C)=O)C(=O)O8)O)CC(C)C(=C7)C(=O)O)OC3C)C)C
Compound: YF-0200R-A
SMILES: O=C(O)/C=C/C=C/CC[C@@H](O)CCCCO
Compound: Streptochlorin
SMILES: ClC=1N=COC1C=2C3=C(C=CC=C3)NC2
Compound: Madurastatin A2
SMILES: O=C1N(O)CCC[C@@H]1NC(=O)C(NC)CCCN(O)C(=O)CCNC(=O)[C@@H](NC(=O)[C@H](NC(=O)C2=C(O)C=CC=C2)CO)C
Compound: Enduracidin
SMILES: ClC1=C(O)C(Cl)=CC(=C1)C2NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(N(C(C(NC(C(C(OC(C(NC(C(NC(C(NC(NC2=O)=O)CC3N=C(N)NC3)=O)C)=O)C4=CC=C(O)C=C4)=O)C)NC(=O)C(NC(=O)C=CC=CCCCCC(CC)C)CC(=O)O)=O)C5=CC=C(O)C=C5)=O)CCCCN)=O)C(O)C)C6=CC=C(O)C=C6)C7=CC=C(O)C=C7)C(O)C)CCCNC(=O)N)CC8N=C(N)NC8)C9=CC=C(O)C=C9)CO.O
Compound: Macrosphelide C
SMILES: O=C1O[C@H](CC=CC(=O)O[C@@H](C)CC(O[C@H]([C@@H](C=C1)O)C)=O)C
Compound: 23-De(mycinosyi) tylosin
SMILES: O=C1C=CC(=CC(C(OC(=O)CC(C(C(C(CC1C)CC=O)OC2OC(C(OC3OC(C(O)C(C3)(O)C)C)C(C2O)N(C)C)C)C)O)CC)CO)C
Compound: Genestein G1
SMILES: O=C1C2=C(OC=C1C3=CC=C(O)C=C3)C=C(O)C=C2OC4O[C@H]([C@H](O)[C@H]([C@H]4O)O)C
Compound: N-(4-Aminobenzenesulfonyl) Sulfamethoxazole
SMILES: S(=O)(=O)(NC1=CC=C(S(=O)(=O)NC2=NOC(=C2)C)C=C1)C3=CC=C(N)C=C3
Compound: Lipohexin
SMILES: O=C(NC(C(=O)NC(C(=O)NCCC(=O)O)(C)C)(C)C)C(NC(=O)C(NC(=O)[C@H]1N(C(=O)C(C(=O)CCCCCCCCCCC)C)CCC1)(C)C)(C)C
Compound: Meropenem sodium carbonate
SMILES: S(C1=C(N2C(=O)C(C2C1C)C(O)C)C(=O)O)C3CNC(C3)C(=O)N(C)C.[Na+].[Na+].O=C([O-])[O-]
Compound: Lepistamide C
SMILES: O=C1N[C@@](OC)(C(=O)N[C@]1(OC)CC2=CC=CC=C2)CC(C)C
Compound: Gentamicin C2a
SMILES: O1C(OC2C(O)C(OC3OCC(O)(C)C(C3O)NC)C(N)CC2N)C(N)CCC1C(N)C
Compound: Eurystatin F
SMILES: O=C1NC(C(=O)NCCCC(C(NC(C1=O)C)=O)NC(=O)/C=C/CCC(CC)C)CC(CC)C
Compound: Clarithromycin related compound I
SMILES: O=C1OC(C(O)(C(O)C(C(=O)C(C)CC(C(C(C(C1C)O)C)OC2OC(CC(C2O)N(C)C)C)(OC)C)C)C)CC
Compound: Trans-7,9-dihydroxy-3-methyl-8-oxo-dodecan-4-olide
SMILES: O=C1O[C@@H](CCC(O)C(=O)C(O)CCC)[C@@H](C1)C
Compound: Luminacin D
SMILES: O=C(C1=C(O)C(=C(O)C(=C1)C(CC)C)C=O)C([C@@H]2O[C@@H](O)[C@]3(O[C@H]3CC)[C@@H](C2)O)C(C)C
Compound: Penicillin-Streptomycin Solution (100X)
SMILES: S1C(C(C(=O)O)N2C1C(NC(=O)CC3=CC=CC=C3)C2=O)(C)C.O=CC1(O)C(OC2OC(C(O)C(C2NC)O)CO)C(OC3C(O)C(O)C(N=C(N)N)C(C3N=C(N)N)O)OC1C
Compound: Reveromycin L
SMILES: O=C(O[C@]1([C@@H](O[C@]2(O[C@@H]([C@@H](C)CC2)C/C=C(/C=C/[C@H](O)[C@H](/C=C/C(=O)O)C)\C)CC1)/C=C/C(=C/C(=O)O)/C)CCCCC)C3=COC(=C3)C(=O)O
Compound: Decladinose Roxithromycin
SMILES: O=C1OC(C(O)(C(O)C(C(=NOCOCCOC)C(C)CC(C(C(C(C1C)O)C)OC2OC(CC(C2O)N(C)C)C)(O)C)C)C)CC
Compound: Sativene Epoxide
SMILES: O1[C@@]2([C@]3([C@H]4[C@@H](O)[C@H]([C@@H]2[C@H]4[C@@H](C(C)C)CC3)O)C)C1
Compound: 1-(3-Chloro-4-fluorophenyl)-3-(thiazol-2-yl)thiourea
SMILES: ClC1=C(F)C=CC(=C1)NC(=S)NC=2SC=CN2
Compound: Thalabetaospiramide A4
SMILES: O=C1N[C@H](C(=O)N([C@H](C(=O)OC[C@@H](C=C1)NC(=O)[C@@H](NC(=O)C[C@H](O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C/C=C\CCCCCC)CC(C)C)C(C)C)CO)C(C)C)CC2=CC=C(O)C=C2)C)C(C)C
Compound: 1-(3,4-Dichlorophenyl)-3-(thiazol-2-yl)thiourea
SMILES: ClC1=C(Cl)C=CC(=C1)NC(=S)NC=2SC=CN2
Compound: Paeciloquinone D
SMILES: O=C1C2=C(O)C(=C(O)C=C2C(=O)C=3C1=C(O)C=C(O)C3)[C@H](C(=O)O)CCO
Compound: Pexiganan acetate
SMILES: O=C(NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N)CCCCN)CCCCN)CC(C)C)CC(C)C)CCCCN)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)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)CN)C(CC)C)CCCCN)CC1=CC=CC=C1)CC(C)C)CCCCN)CCCCN)C)CCCCN)CCCCN)CC2=CC=CC=C2)CCCCN)C)CC3=CC=CC=C3)C(C)C.O=C(O)C
Compound: 1-Cyclohexyl-3-(1,3-thiazole-2-yl)thiourea
SMILES: S=C(NC=1SC=CN1)NC2CCCCC2
Compound: Inonotic acid A
SMILES: O=C(O)C(CCC=C([C@@H]1C[C@H](O)[C@@](O)(C)CC1)C)C
Compound: GE 23077A1
SMILES: O=C1NC(C(=O)NC(C(=O)NC(C(=O)NC(C(O)C(O)C(=O)N)C(NC(C(NCC(C(NC1C(=O)O)=O)O)=O)C(O)C)=O)C(C)C)CO)CNC(=O)C(=CC)C
Compound: 27-O-methylasporyzin C
SMILES: O(C(C=CC[C@@]1([C@@H](O)CC[C@]2([C@H]1CC[C@@H]3[C@@]2(C=4NC=5C=CC=CC5C4C3)C)C)C)(C)C)C
Compound: DMAPT
SMILES: O=C1OC2C3OC3(CCC=C(CCC2C1CN(C)C)C)C
Compound: Mycenon
SMILES: ClC1=C(O)C(C#CC(=CCl)C)=C(Cl)C(C1=O)=O
Compound: Antimycin A2
SMILES: O=C1OC(C(OC(=O)CCC)C(CCCCCC)C(OC(C1NC(=O)C2=C(O)C(NC=O)=CC=C2)C)=O)C
Compound: (-)-chizhine F
SMILES: O=C1O[C@H](C2=C(O)C=CC(=C2)O)C=C1CCC=C(CC(=O)C=C(C)C)C
Compound: beta-Apooxytetracycline
SMILES: O=C1C(=C(O)C(N(C)C)C(C1O)C2OC(=O)C=3C2=C(C=4C(=C(O)C=CC4)C3O)C)C(=O)N
Compound: Proximicin C
SMILES: O=C(OC)NC1=COC(=C1)C(=O)NC2=COC(=C2)C(=O)NCCC=3C4=C(C=CC=C4)NC3
Compound: 4-epi-Chlortetracycline Hydrochloride
SMILES: ClC1=C2C(C(O)=C3C(=O)C4(O)C(O)=C(C(=O)N)C(C(C4CC3C2(O)C)N(C)C)=O)=C(O)C=C1.Cl
Compound: Cercophorin B
SMILES: O=C1OC(=CC=2C1=C(O)C(=C(O)C2)C(=O)OC3=C(O)C(C(=O)OC)=CC(=C3)OC)C
Compound: Viridicatol
SMILES: O=C1NC2=C(C=CC=C2)C(=C1O)C3=CC(O)=CC=C3
Compound: Chalcomycin A
SMILES: O=C1OC(C(C2OC2C=CC(=O)C(CC(C(C(C=C1)C)O[C@H]3O[C@H](C[C@H]([C@@H]3O)OC)C)C)(O)C)CO[C@@H]4O[C@@H]([C@@H](O)[C@H]([C@H]4OC)OC)C)C
Compound: Fosmidomycin sodium salt
SMILES: P(=O)(O)([O-])CCCN(O)C=O.[Na+]
Compound: (3aS,6S,7R,7aS)-6,7-dihydroxy-6-methylhexahydro-2H-spiro-[benzofuran-3,2′-oxiran]-2-one
SMILES: O=C1O[C@@H]2[C@@H](O)[C@](O)(C)CC[C@@H]2C13OC3
Compound: Epianhydrochlortetracycline hydrochloride
SMILES: ClC=1C=2C(=C(O)C=3C(=O)C4(O)C(O)=C(C(=O)N)C(C(C4CC3C2C)N(C)C)=O)C(O)=CC1.Cl
Compound: Miophytocen C
SMILES: O=C1OC[C@@]23C4(C5(O)C(O[C@@H]2[C@@H]([C@](O)(C)CC3)C5)C(C4OC(=O)C=CC=C[C@@H]6O[C@H](CC(=C1)C)O[C@H]6C)O)C
Compound: Sulfinemycin
SMILES: S(=O)=C(N)/C=C/CCCCCCCCCCC(C)C
Compound: Threo-6'-Hydroxyustusolate C
SMILES: O=C1OCC=2C1(O)C3(C(C(CCC3)(C)C)C(C2)OC(=O)C=CC=CC(O)C(O)C)C
Compound: 1,4,6-trihydroxy-8-propyl-9,10-anthraquinone
SMILES: O=C1C2=C(C(=O)C3=C1C(=CC(=C3)O)CCC)C(O)=CC=C2O
Compound: 2alpha,9alpha,11-Trihydroxy-6-oxodrim-7-ene
SMILES: O=C1C=C(C(O)(CO)C2(C1C(CC(C2)O)(C)C)C)C
Compound: Shearinine J
SMILES: O=C1NC2=C(C(=O)C[C@H]3[C@]1([C@@]4([C@](O)(C5=CC(=O)[C@@H]6O[C@]5(OC6(C)C)CC4)CC3)C)C)C=C(CC=C(C)C)C(=C2)CC=C(C)C
Compound: Aflavarin
SMILES: O=C1OC2=C(C(=CC(=C2)OC)CO)C(=C1C3=C4OC(=O)C=C(C4=C(C)C=C3OC)OC)OC
Compound: Halawanone D
SMILES: O=C1C2=C(O)C=CC=C2C(=O)C3=C1C(=CC(=C3)O[C@@H]4O[C@@H]([C@@H](O)[C@@H](C4)O)C)CC
Compound: 6,8-Di-O-methylcitreoisocoumarin
SMILES: O=C1OC(=CC=2C1=C(OC)C=C(OC)C2)C[C@@H](O)CC(=O)C
Compound: 2,3,10,11-tetrahydropyrenophorol
SMILES: O=C1O[C@@H](CC[C@H](O)CCC(=O)O[C@@H](CC[C@@H](CC1)O)C)C
Compound: Prehelminthosporolactone
SMILES: O=C1OCC2C3C1C(=C)C2(CCC3C(C)C)C
Compound: Nocarimidazole A
SMILES: O=C(C=1NC=NC1N)CCCCCCC(C)C
Compound: Prehelminthosporol
SMILES: O1C(O)C2C(=C)C3(C(C1)C2C(C(C)C)CC3)C
Compound: Squalestatin S3
SMILES: O=C(O[C@H]1[C@]2(O[C@@]([C@@H]1O)(O[C@@H]([C@@]2(O)C(=O)O)C(=O)O)CCC(=C)C(O)C(CO)CC3=CC=CC=C3)C(=O)O)/C=C/[C@H](C[C@H](CC)C)C
Compound: Stachybotramide
SMILES: O=C1N(CC2=C1C=C(O)C3=C2OC4(C5(C(C(C(O)CC5)(C)C)CCC4C)C)C3)CCO
Compound: Beticolin 4
SMILES: ClC1=C2O[C@]3(C(C(=O)CC[C@@H]3O)=C(C2=C(O)C4=C1C[C@@]56C(=O)C7=C(C(O)=CC=C7O)C(=C5C([C@@H]4C8(OC68)CO)=O)O)O)C(=O)OC
Compound: Stachybotrolide
SMILES: O=C1OCC2=C1C=C(O)C3=C2OC4(C5(C(C(C(O)CC5)(C)C)CCC4C)C)C3
Compound: Methylinoscavin B
SMILES: O=C1OC(=CC2=C1/C(=C/C3=CC(O)=C(O)C=C3)/[C@](OC)(C)O2)/C=C/C4=CC(OC)=C(O)C=C4
Compound: Secolongifolenediol
SMILES: OCC1=CC2C(CCCC1(C2CCO)C)(C)C
Compound: Cyclo-[isoleucyl-prolyl-leucyl-alanyl]
SMILES: O=C1N2[C@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H]1CC(C)C)=O)C)[C@H](CC)C)CCC2
Compound: Stachartin E
SMILES: O=C1N(C(C(=O)OC)CC2=CC=CC=C2)CC3=C1C=C(O)C4=C3OC5(C6(C(C(C(O)CC6)(C)C)CCC5C)C)C4
Compound: Penilumamide B
SMILES: S(CC[C@H](NC(=O)C1=NC=2C(=O)N(C(=O)N(C2N=C1)C)C)C(=O)NC3=C(C(=O)OC)C=CC=C3)C
Compound: Stachartin C
SMILES: O=C1N(C(C(=O)OC)C(C)C)CC2=C1C=C(O)C3=C2OC4(C5(C(C(C(O)CC5)(C)C)CCC4C)C)C3
Compound: Petromurin D
SMILES: O(C1=C(OC)C(=C(OC)C(=C1C=2C3=C(C=C(OC)C=C3)NC2)OC)C=4C5=C(C=C(O)C=C5)NC4)C
Compound: 1-Hydroxybisabola-2,10-dien-4-one
SMILES: O=C1C(=CC(O)C(C1)C(CCC=C(C)C)C)C
Compound: Pestalafuranone G
SMILES: O=C1OCC(=C1C=CC)CC[C@@H](O)C
Compound: Stachartin D
SMILES: O=C1N(C(C(=O)OC)CC(C)C)CC2=C1C=C(O)C3=C2OC4(C5(C(C(C(O)CC5)(C)C)CCC4C)C)C3
Compound: 6,1′-O,O-dimethylaverantin
SMILES: O=C1C2=C(O)C(=C(O)C=C2C(=O)C=3C1=C(O)C=C(OC)C3)[C@@H](OC)CCCCC
Compound: Dihydroprehelminthosporol
SMILES: OCC1C(=C)C2(CCC(C1C2CO)C(C)C)C
Compound: 11-Oacetyl-NGA0187
SMILES: O=C1[C@H](O)[C@@H]2[C@H]([C@@H](OC(=O)C)C[C@]3([C@H]2C[C@H](OC(=O)C)[C@@H]3[C@@H](/C=C/[C@@H](C(C)C)C)C)C)[C@@]4([C@@H]1C[C@@H](O)CC4)C
Compound: Axinysone B
SMILES: O=C1C=C2C(C(CCC2O)C)(C)C3C1C3(C)C
Compound: Hydroisoflavone C
SMILES: O=C1C2=C(OC=C1C3(O)CCC(O)CC3)C=C(O)C=C2O
Compound: Epitrametol
SMILES: ClC1=C(OC)C=CC(=C1)C(O)C(O)C
Compound: Mangromicin E
SMILES: O=C1C(=C[C@@H](O)[C@@H]2O[C@](CCC3C(O[C@H](C1)[C@H](C3=O)CCC)=O)(C)C[C@@H]2C)C
Compound: Victoxinine
SMILES: OCCN1CC2C(=C)C3(C(C1)C2C(C(C)C)CC3)C
Compound: Orirubenone D
SMILES: O=C(O)/C(=C/CC/C(=C/C(=O)C1=C(O)C=CC(=C1)O)/C)/C
Compound: FD-838
SMILES: O=C1NC(OC)(C(=O)C2=CC=CC=C2)C(C13OC(C=4OC(CC)=CC4)=C(C3=O)C)O
Compound: Alectosarmentin
SMILES: O=C1O[C@H](O)C=2C1=C(O)C=C3OC=4C(C23)=C(C=C(O)C4)C
Compound: Cyclo(D-Phe-L-Pro)
SMILES: O=C1N2C(C(=O)NC1CC3=CC=CC=C3)CCC2
Compound: Pimara-7,15-diene
SMILES: C12=CC[C@H]3C(CCC[C@@]3(C1CC[C@](C2)(C=C)C)C)(C)C
Compound: Cyclo(D-Val-L-Pro)
SMILES: O=C1N2C(C(=O)NC1C(C)C)CCC2
Compound: SMTP-8
SMILES: O=C1N(C(C(=O)O)CCCCN2C(=O)C=3C=C(O)C4=C(C3C2)OC(C(O)C4)(CCC=C(CCC=C(C)C)C)C)CC5=C1C=C(O)C6=C5OC(C(O)C6)(CCC=C(CCC=C(C)C)C)C
Compound: Albrassitriol
SMILES: OC1(C(=CC(O)C2C1(CCCC2(C)C)C)C)CO
Compound: Chlorofusin
SMILES: ClC=1C(=O)[C@@](OC(=O)CCC)(C(=O)C=2C1[C@@H]([C@]3(OCCC3)N(C2)CCC[C@H]4NC(=O)[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@H](NC(C(NC(C(NC([C@@H](NC([C@@H](NC4=O)[C@H](O)C)=O)C)=O)CC(=O)N)=O)CC(=O)N)=O)CC(C)C)[C@H](O)C)CC(C)C)CCCCCCCC)C)C
Compound: 6,11-Di-O-acetylalbrassitriol
SMILES: O=C(OC1C=C(C(O)(COC(=O)C)C2(C1C(CCC2)(C)C)C)C)C
Compound: N-methyl-4-nitrotryptophan
SMILES: O=[N+]([O-])C1=C2C(NC=C2C[C@H](NC)C(=O)O)=CC=C1
Compound: 6beta-(Hexa-2,4-dienoyloxy)-9alpha,12-dihydroxydrimenol
SMILES: O=C(OC1C=C(C(O)(CO)C2(C1C(CCC2)(C)C)C)CO)C=CC=CC
Compound: 5,7,3',4'-Tetrahydroxy-8-methylisoflavan
SMILES: O=C1C2=C(OC[C@H]1C3=CC(O)=C(O)C=C3)C(=C(O)C=C2O)C
Compound: Amphomycin
SMILES: O=C1N2C(C(=O)NC1C(NC(=O)C3N(C(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CC=CCCCCCC(CC)C)CC(=O)O)C(C(=O)O)C)CC(=O)O)CC(=O)O)C(N)C)C(C)C)CCC3)C)CCCC2
Compound: Cryptoporic acid Q
SMILES: O=C(OC)[C@H](OC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@]2(COC(=O)C)C)C)[C@H](C(=O)OC)CC(=O)O
Compound: Virustomycin A
SMILES: O=C1OC(C(OC)C=CC=C(CC(C)C(C(C(C(C=C(C=C1OC)C)C)O)CC)O)C)C(C(O)C(C2(OC(C=CC)C(C)C(C2)OC(=O)C=CC(=O)NC3=C(O)CCC3=O)O)C)C
Compound: USF-142A
SMILES: O=C(N)CC(=O)C1=C(C=CC=C1)C
Compound: Butylrolactone IV
SMILES: O=C1O[C@](C(=O)OC)(CC2=CC3=C(O[C@H](C3)C(O)(C)C)C=C2)C(=C1O)C4=CC=C(O)C=C4
Compound: Cephradine monohydrate
SMILES: S1C2N(C(C(=O)O)=C(C1)C)C(=O)C2NC(=O)C(N)C3=CCC=CC3.O
Compound: Triacetylphloroglucinol
SMILES: O=C(C1=C(O)C(=C(O)C(=C1O)C(=O)C)C(=O)C)C
Compound: Fascicularone I
SMILES: O=C1O[C@@H]2[C@@]3(O)[C@](C1(O)[C@@H](O)[C@H]3C)([C@H]4CC([C@@H]24)(C)C)C
Compound: Anhydroerythromycin A
SMILES: O=C1OC(C2(OC3(OC(C(C(C(C1C)OC4OC(C(O)C(C4)(OC)C)C)C)OC5OC(CC(C5O)N(C)C)C)(CC3C)C)C(C2O)C)C)CC
Compound: (-)-Agaridiol
SMILES: O=C(NC1=C(OC)C=CC(=C1)[C@@H](O)[C@H](O)C)C
Compound: Clarithromycin related compound C
SMILES: O=C1OC(C(O)(C(O)C(C(=NO)C(C)CC(C(C(C(C1C)OC2OC(C(O)C(C2)(OC)C)C)C)OC3OC(CC(C3O)N(C)C)C)(OC)C)C)C)CC
Compound: 1-[(1S,3S)-3-(Bromomethyl)-1-methyl-2-methylenecyclopentyl]-4-methyl-1,4-cyclohexadiene
SMILES: BrC[C@@H]1C(=C)[C@@](C2=CCC(C)=CC2)(C)CC1
Compound: Roxithromycin Impurity F
SMILES: O=C1OC(C(O)(C(O)C(C(=NOCOCCOC)C(C)CC(C(C(C(C1C)OC2OC(C(O)C(C2)(OC)C)C)C)OC3OC(CC(C3O)NC)C)(O)C)C)C)CC
Compound: Cyafrin A4
SMILES: O=C1C=C([C@H](O)C[C@H]2[C@]1(CC[C@@]3(C2=C(C(C)C)C[C@H]3O)C)C)CO
Compound: N-Desmethyl Clarithromycin
SMILES: O=C1OC(C(O)(C(O)C(C(=O)C(C)CC(C(C(C(C1C)OC2OC(C(O)C(C2)(OC)C)C)C)OC3OC(CC(C3O)NC)C)(OC)C)C)C)CC
Compound: T1801 D
SMILES: S(C1=C(SC)C(=O)C(SC)=C(C1=O)SC)C
Compound: Dihydropleuromutilin
SMILES: O=C1C2C3(C(OC(=O)CO)CC(CC)(C)C(C(C2(CCC3C)CC1)C)O)C
Compound: Sartorymensin
SMILES: O=C1N2C(=NC3=C1C=CC=C3)[C@]4(NC([C@@H]2CC=5C=6C=CC=CC6NC45)=O)C(C)C
Compound: Penifulvin D
SMILES: O=C1O[C@H]2OC(=O)[C@]3([C@]24[C@@H](CC3)C(C[C@@]4(C1)C)(C)C)O
Compound: Precyclocitrinol B
SMILES: O=C1C=C2[C@H](CC[C@]3([C@H]2CCC3[C@]4(OC4/C=C/C)C)C)C=5C[C@H]1C[C@@H](O)CC5
Compound: Icaritin
SMILES: O=C1C(O)=C(OC2=C1C(O)=CC(=C2CC=C(C)C)O)C3=CC=C(OC)C=C3
Compound: Phomallenic acid A
SMILES: O=C(O)CCCCC=C=CC#CC#CC(O)CC
Compound: Isocyclosporin A
SMILES: O=C1OC(C(NC)C(=O)NC(C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N(C)C(C(NC(C(NC(C(N(C(C(N(C(C(N(C1C(C)C)C)=O)CC(C)C)C)=O)CC(C)C)C)=O)C)=O)C)=O)CC(C)C)C(C)C)CC(C)C)C)C)CC)C(CC=CC)C
Compound: Lachnumol A
SMILES: Cl/C(=C\C)/C12OC1(Cl)C(O)C=C(C2O)OC
Compound: Oxytetracycline Impurity A
SMILES: O=C1C2=C(O)C3=C(O)C=CC=C3C(C2C(O)C4C1(O)C(O)=C(C(=O)C4N(C)C)C(=O)N)(O)C
Compound: Oxolobaric acid
SMILES: O=C1OC2=C(C(=C(C(=O)O)C(=C2)O)CCCCC)OC3=C1C(C(=O)CCC(=O)C)=CC(=C3)OC
Compound: Pirlimycin Hydrochloride
SMILES: ClC(C(NC(=O)C1NCCC(C1)CC)C2OC(SC)C(O)C(C2O)O)C.Cl
Compound: (-)-dalmanol C
SMILES: O=C1C=2C3=C(C(O)=CC(=C3[C@@H](C)[C@@H](C2C4=C(O)C=CC=C4O)[C@H](CC(=O)C5=C(O)C=CC=C5O)C)O)C(=C1)O
Compound: Sancycline hydrochloride
SMILES: Cl.O=C1C2=C(O)C3=C(O)C=CC=C3CC2CC4C1(O)C(O)=C(C(=O)C4N(C)C)C(=O)N
Compound: Surugamide D
SMILES: O=C1N[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]1[C@H](CC)C)=O)CCCCN)=O)[C@@H](CC)C)=O)C(C)C)C)[C@H](CC)C)CC(C)C)CC2=CC=CC=C2
Compound: Stauprimide
SMILES: O=C1NC(=O)C2=C1C3=C4N(C5(OC(N6C4=C2C7=C6C=CC=C7)CC(C5OC)N(C(=O)C8=CC=CC=C8)C)C)C9=C3C=CC=C9
Compound: Austrocortilutein
SMILES: O=C1C2=C(O)C=C(OC)C=C2C(=O)C3=C1[C@@H](O)C[C@](C3)(O)C
Compound: 17-Hydroxy-18-dehydroneogrifolin
SMILES: OC1=C(C(=CC(=C1)O)C)CC=C(CCC=C(CC[C@H](O)C(=C)C)C)C
Compound: Dermocanarin 8
SMILES: O=C1OC=2C3=C(O)C=4C(=O)C[C@@](O)(C)CC4C=C3C=C(C2C=5C(=O)C=6C(OC)=CC(=CC6C(C5C[C@@](C1)(O)C)=O)OC)CO
Compound: 5-Acetyl-2-(1-hydroxy-1-methylethyl)benzofuran
SMILES: O=C(C1=CC2=C(OC(=C2)C(O)(C)C)C=C1)C
Compound: Muroxanthenone C
SMILES: O=C1C2=C(C(O)=CC=C2OC3=C1C(OC)=CC(=C3)CCO)C(=O)OC
Compound: Citromycin
SMILES: O=C1C2=C(OC(=C1)C)C3=C(C=C(O)C(=C3)O)OC2
Compound: Circulocin delta
SMILES: O=C1O[C@@H]([C@H](NC(=O)CC(O)CCCCCCCCCCCCCCCCN=C(N)N)C(=O)N[C@@H](C(=O)N[C@@H]([C@H](CC)C)C(N[C@@H](C(N[C@@H](C(N[C@@H]1C)=O)CC(=O)N)=O)[C@H](O)C)=O)CC(C)C)C
Compound: Tetrahymanone
SMILES: O=C1C(C2C(C3C(C4(C(C5(C(C(CCC5)(C)C)CC4)C)CC3)C)(C)CC2)(C)CC1)(C)C
Compound: R176502
SMILES: O=C1O[C@@H]([C@@H](OC)C=CC=C(C[C@@H]([C@@H]([C@@H](C=C(C=C1OC)C)C)O)C)C)[C@H]([C@@H](O)[C@@H]([C@@]2(O[C@H](/C=C/C=C/CC)[C@@H](C)[C@@H](C2)OC(=O)/C=C/C(=O)NC3=C(O)CCC3=O)O)C)C
Compound: Tetrahymanol acetate
SMILES: O=C(OC1C(C2C(C3C(C4(C(C5(C(C(CCC5)(C)C)CC4)C)CC3)C)(C)CC2)(C)CC1)(C)C)C
Compound: Hypocoprin A
SMILES: O[C@@]1([C@@H]2[C@@H](C(C[C@@H](O)C(=CCC1)C)(C)C)C2)C
Compound: Cyclo(L-Leu-trans-4-hydroxy-L-Pro)
SMILES: O=C1N2C(C(=O)NC1CC(C)C)CC(C2)O
Compound: (5S)-2-(3,5-dihydroxyphenyl)-5-hydroxy-3-methylcyclopent-2-en-1-one
SMILES: O=C1C(C2=CC(O)=CC(=C2)O)=C(C)C[C@@H]1O
Compound: 20-Hydroxyaflavinine
SMILES: OC1C2(C3(C(C(=C(C(C)C)CC3)C=4C5=C(C=CC=C5)NC4)C(C1)C)C(O)CCC2C)C
Compound: Thiochondrilline A
SMILES: S(C[C@H](N(C(=O)[C@@H](N(C(=O)CNC(=O)[C@H](NC(=O)C1=NC=2C(=CC=CC2)C=C1O)CSC)C)CSC)C)C(=O)OC)C
Compound: 10,11-Dihydro-24-hydroxyaflavinine
SMILES: OC(C1C(C=2NC=3C=CC=CC3C2)C4C5(C(C(CC(C5)O)C)(CCC4C)C)CC1)(C)C
Compound: Acetyl ganohainanic acid D
SMILES: O=C1C2=C([C@]3(CCC([C@]([C@@H]3C1)(COC(=O)C)C)=O)C)CC[C@]4([C@]2([C@H](O)C[C@@H]4[C@@H](CC(=O)C[C@@H](C(=O)O)C)C)C)C
Compound: Aflavazole
SMILES: OC1C2(C3(C(C4=C(C(=CC5=C4C6=C(C=CC=C6)N5)C)CC3)C(C1)C)C(O)CCC2C)C
Compound: F-10748 B2
SMILES: O=C(OC1C(OC2OC(C(O)C(C2O)O)COC(=O)CCC)C(OC(C1O)C3=C(O)C=C(O)C=C3CO)CO)/C=C/C=C/CC(O)C(CCC/C=C/C(CC)C)C
Compound: Monohydroxyisoaflavinine
SMILES: OC1C2(C3(C(C(C=4C5=C(C=CC=C5)NC4)C(C(=C)C)CC3)C(C1)C)C(O)CCC2C)C
Compound: Sterostrein O
SMILES: O=C1C2=C(C=CN=C2)[C@](O)(C)C3=C1CC(C)(C)C3
Compound: Dihydroxyaflavinine
SMILES: OC1C2(C3(C(C(=C(C(CO)C)CC3)C=4C5=C(C=CC=C5)NC4)C(C1)C)C(O)CCC2C)C
Compound: Officimalonic acid G
SMILES: O=C(O)[C@H](C(C(=O)C[C@H]([C@@H]1[C@@]2([C@@](C3=C([C@@]4([C@H](C([C@H](OC(=O)CC(=O)OC)CC4)(C)C)CC3)C)C[C@H]2O)(C)CC1)C)C)=C)C
Compound: Deacetylravidomycin
SMILES: O=C1OC=2C=3C(C(OC)=CC2C4=C1C=C(C=C)C=C4OC)=C(O)C=CC3C5OC(C(O)C(C5O)N(C)C)C
Compound: (+)-Asperlin
SMILES: O=C1O[C@H]([C@@H](OC(=O)C)C=C1)[C@H]2O[C@@H]2C
Compound: Kazusamycin A
SMILES: O=C1OC(C=CC(=CC(CC=CC(=CC(C(=O)C(C(O)C(CC(=CC(=O)O)C)C)C)CO)C)C)CC)C(C)C=C1
Compound: (E)-4-[(1S,2S,6S)-4-[chloro(methoxy)methyl]-2-hydroxy-3-(2-hydroxyheptyl)-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-1-yl]-2-methylbut-2-enoic acid
SMILES: ClC(OC)C=1C(=O)[C@H]2O[C@@]2(C/C=C(/C(=O)O)\C)[C@H](C1CC(O)CCCCC)O
Compound: Cefixime trihydrate
SMILES: S1C2N(C(C(=O)O)=C(C1)C=C)C(=O)C2NC(=O)C(=NOCC(=O)O)C=3N=C(N)SC3.O.O.O
Compound: Necpyrone B
SMILES: O=C1O[C@H]([C@@H](O)CC[C@H](O)C)CC(=C1)OC
Compound: (S)-2-Amino-2-(1-methylcyclopropyl)acetic acid hydrochloride
SMILES: Cl.O=C(O)[C@@H](N)C1(CC1)C
Compound: Applanoxidic acid D
SMILES: O=C1C=C2[C@@]3([C@H](C([C@@H](O)CC3)(C)C)C[C@@H]4[C@]2(O4)[C@]5([C@]1([C@@H](C(CC(=O)CC(C(=O)O)C)C)CC5=O)C)C)C
Compound: BTS 44595
SMILES: ClC1=C(OCCN(C(=O)N)CCC)C(Cl)=CC(=C1)Cl
Compound: 6-prenyltryptophol
SMILES: OCCC=1C2=C(C=C(CC=C(C)C)C=C2)NC1
Compound: 1,4-Diaminobutane dihydrochloride
SMILES: Cl.Cl.NCCCCN
Compound: Pitholide D
SMILES: O=C1O[C@@]2([C@H](O)C3=COC(=CC3=CC2=C1C(=O)CCCCCCC)C)C
Compound: Kumbicin C
SMILES: O1C2=C(C(OC)=C(O)C(=C2C=CC1(C)C)C=3C4=C(C=CC=C4)NC3)C=5C6=C(C=CC=C6)NC5
Compound: Ambuic acid
SMILES: O=C1C(=C(C(O)C2C1(O2)C/C=C(/C(=O)O)\C)CO)/C=C/CCCCC
Compound: Asterriquinol D dimethyl ether
SMILES: O(C1=C(OC)C(=C(OC)C(=C1C=2C3=C(C=CC=C3)NC2)OC)C=4C5=C(C=CC=C5)NC4)C
Compound: Azicemicin B
SMILES: O=C1C2=C(O)C3=C(O)C(OC)=C(O)C=C3C(=C2C4(O)C(=O)CC(CC4C1)(O)C5NC5)OC
Compound: Harpin
SMILES: S(CCC(N)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)NCC(=O)NC(C(=O)N)C)CC(C)C)CO)C(O)C)CC(=O)N)CC(C)C)CO)C
Compound: O-Methylviridicatin
SMILES: O=C1NC2=C(C=CC=C2)C(=C1OC)C3=CC=CC=C3
Compound: Amidepsine D
SMILES: O=C(OC1=CC(O)=C(C(=O)OC2=CC(O)=C(C(=O)O)C(=C2)C)C(=C1)C)C3=C(OC)C=C(OC)C=C3C
Compound: (Z,Z)-10,14-eicosadienoic acid
SMILES: O=C(O)CCCCCCCC/C=C\CC/C=C\CCCCC
Compound: Kanosamine Hydrochloride
SMILES: Cl.O=CC(O)C(N)C(O)C(O)CO
Compound: Moriniafungin
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)O
Compound: Mortivinacin C
SMILES: O=C(N[C@H](C(=O)OC)C)C1=C(O)C(=C(O)C(=C1C)C)C
Compound: Phanerosporic acid
SMILES: O=C(O)C1=C(O)C=C(O)C=C1CCCCCCCCCCCCC[C@@H](O)C
Compound: Penexanthone A
SMILES: O=C1C2=C(O)C3=C(C(C4=C(O)C=5C(O)=C6C(=O)C[C@@H](C)[C@H]([C@@]6(CO)OC5C=C4)OC(=O)C)=CC=C3O)O[C@@]2([C@H](OC(=O)C)[C@@H](C1)C)COC(=O)C
Compound: Spirolaxine
SMILES: O=C1OC(CCCCCC2OC3(OC(C)CC3)CCC2)C=4C1=C(OC)C=C(O)C4
Compound: Sarubicin B
SMILES: O=C1C(=N)C(=C(O)C2=C1C(C(=O)C)=CC=C2)C(=O)N
Compound: Ristocetin A sulfate
SMILES: S(=O)(=O)(O)O.O=C1NC2C(=O)NC(C(=O)NC(C(=O)OC)C=3C(C=4C=C2C=CC4O)=C(OC5OC(C(O)C(C5O)O)CO)C=C(O)C3)C(OC6OC(C(O)C(C6)N)C)C7=CC=C(OC8=CC=9C1NC(=O)C%10NC(=O)C(NC(=O)C(N)C=%11C=CC(=C(OC=%12C=C%10C=C(O)C%12C)C%11)O)C(O)C%13=CC=C(OC(C9)=C8OC%14OC(C(O)C(C%14OC%15OC(C(O)C(C%15OC%16OCC(O)C(C%16O)O)O)CO)O)COC%17OC(C(O)C(C%17O)O)C)C=C%13)C=C7
Compound: 1alpha,6beta,11-eudesmanetriol
SMILES: OC([C@@H]1[C@@H](O)[C@H]2[C@]([C@@H](O)CC[C@H]2C)(C)CC1)(C)C
Compound: Bisabosqual D
SMILES: O=CC1=C(C=C2O[C@](CC[C@@H](O)C(O)(C)C)(C)[C@H]3[C@H]4C2=C1O[C@H]4[C@@](O)(CC3)C)C=O
Compound: 2-Mercaptopyridine N-oxide sodium salt
SMILES: S=C1N([O-])C=CC=C1.[Na+]
Compound: Sterostrein Q
SMILES: O=C1C2=C(C=CN=C2)[C@@](O)(C)[C@@H]3C1=CC(C)(C)C3
Compound: OM-173alphaA
SMILES: O=C1C2=C(O)C=CC=C2C(=O)C3=C1C(OC(C3)CC(=O)OC)C
Compound: Eujavanoic acid B
SMILES: O=C(O)CC[C@@H]1[C@@H]2[C@@H](C=C[C@@H]1C)C[C@@H](O)CC2
Compound: 16-Deethylindanomycin
SMILES: O=C(C=1NC=CC1)C2C(C=CC3C2CCC3)C=CC=C(C4OC(C(C(=O)O)C)CCC4C)CC
Compound: Hypsiziprenol-B10
SMILES: OC(C=C)(CC/C=C(/CC/C=C(/CCCC(O)(CCCC(O)(CCCC(O)(CCCC(O)(CCCC(O)(CCCC(O)(CCC=C(C)C)C)C)C)C)C)C)\C)\C)C
Compound: A-54556B
SMILES: O=C1N2C(C(=O)N(C(C(=O)NC(C)C(N3C(C(OCC1NC(=O)C(NC(=O)C=CC=CC=CC)CC4=CC=CC=C4)=O)CCC3)=O)C)C)CCC2
Compound: Hapalindole Q
SMILES: S=C=N[C@H]1[C@@](C=C)(CC[C@H]([C@@H]1C=2C3=C(C=CC=C3)NC2)C(=C)C)C
Compound: CBM 301940
SMILES: FC(F)(F)C(O)(C(F)(F)F)C1ON=C(C1)C(=O)NC(CCOC(=O)(C)(C)C)C
Compound: Maremycin D2
SMILES: O=C1N[C@H](C(=O)NC1=C)[C@H]([C@]2(O)C(=O)N(C)C3=C2C=CC=C3)C
Compound: Trisdechloronornidulin
SMILES: O=C1OC2=C(C(C(=CC)C)=CC(=C2C)O)OC3=C1C(=CC(=C3)O)C
Compound: Primycin
SMILES: O=C1OC(C(C=C(CCCCC(O)CC(O)CC(O)CC(O)CC(O)C(C=C(C(CCCC(CCCC(CCC(C(C1CCCC)O)C)O)O)O)C)O[C@H]2O[C@H](CO)[C@H]([C@@H]2O)O)C)C)C(C(O)CCCN=C(N)N)C
Compound: Anhydrotetracycline hydrochloride
SMILES: Cl.O=C1C2=C(O)C3=C(O)C=CC=C3C(=C2CC4C1(O)C(O)=C(C(=O)C4N(C)C)C(=O)N)C
Compound: Microviridin I
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)O)CC2=CC=C(O)C=C2)CC(=O)NCCCC[C@@H]3NC(=O)[C@@H](NC([C@H]([C@H](OC(C[C@H]4C(N[C@H](C(N[C@H]1CCC(=O)OC[C@H](NC(=O)[C@H]5N(C(=O)[C@@H](NC3=O)CC6=CC=C(O)C=C6)CCC5)C(=O)N4)=O)CC=7C8=C(C=CC=C8)NC7)=O)=O)C)NC(=O)[C@@H](NC(=O)[C@@H]9N(C(=O)[C@@H](NC(=O)C)CC%10=CC=C(O)C=C%10)CCC9)[C@H](O)C)=O)CC(C)C
Compound: Okaspirodiol
SMILES: O1[C@@]2(OC[C@@H]([C@@H]2O)CO)CCC[C@@H]1C
Compound: Clavulanate Lithium
SMILES: O=C1N2C(C(=CCO)OC2C1)C(=O)[O-].[Li+]
Compound: Butyrolactone VI
SMILES: O=C1O[C@](C(=O)OC)(CC2=CC(=C(O)C=C2)CC(O)C(O)(C)C)C(=C1O)C3=CC=C(O)C=C3
Compound: Clindamycin 2-Phosphate
SMILES: ClC(C(NC(=O)C1N(CC(C1)CCC)C)C2OC(SC)C(OP(=O)(O)O)C(C2O)O)C
Compound: RS-22A
SMILES: O=C1OC(C(C=CC=C(C(O)CC(O)CC(O)CC(OC(=O)CC(=O)O)CC2OC(CC(C(CCC(C(C(CC(C(C=CC=C1)C)O)O)C)O)C)O)(O)C(O)C(C2)O)C)C)C(CCC/C=C/CCCN=C(N)N)C
Compound: Epitetracycline hydrochloride
SMILES: Cl.O=C1C2=C(O)C3=C(O)C=CC=C3C(C2CC4C1(O)C(O)=C(C(=O)C4N(C)C)C(=O)N)(O)C
Compound: Carriebowmide
SMILES: S(=O)(CC[C@@H]1NC(=O)[C@H](N(C(=O)[C@H](OC(=O)[C@@H]([C@H](NC([C@@H](NC([C@@H](N(C([C@@H](NC1=O)CC2=CC=CC=C2)=O)C)CC(C)C)=O)C)=O)CCC)C)C(C)C)C)CC3=CC=CC=C3)C
Compound: Fentrazamide Metabolite
SMILES: ClC1=C(N2N=NNC2=O)C=CC=C1
Compound: Acremonidin B
SMILES: O=C1C2=C(O)C3=C(O)C=C(C)C=C3[C@@H]([C@]24C=C[C@@H]1C5=C(O)C(=C(O)C=C5C4)C(=O)C6=C(C(O)=CC=C6O)C(=O)OC)O
Compound: Mupirocin Lithium
SMILES: O=C(OCCCCCCCCC(=O)[O-])C=C(CC1OCC(CC2OC2C(C(O)C)C)C(C1O)O)C.[Li+]
Compound: Butyrolactone IX
SMILES: O=C1O[C@](O)(CC2=CC(=C(O)C=C2)CC=C(C)C)C(=C1)C3=CC=C(O)C=C3
Compound: 3beta-hydroxy-1,11-dioxo-ergosta-8,24(28)-diene-4alpha-carboxylic acid
SMILES: O=C1C2=C([C@@H]3CC[C@@H]([C@]3(C1)C)[C@@H](CCC(=C)C(C)C)C)CC[C@@H]4[C@@]2(C(=O)C[C@H](O)[C@H]4C(=O)O)C
Compound: N-Demethylerythromycin A
SMILES: O=C1OC(C(O)(C(O)C(C(=O)C(C)CC(C(C(C(C1C)OC2OC(C(O)C(C2)(OC)C)C)C)OC3OC(CC(C3O)NC)C)(O)C)C)C)CC
Compound: Chaetocochin B
SMILES: S1S[C@@]23N([C@H]4N5C=6C=CC=CC6[C@]4(C2)N7C8=C(C=CC=C8)C(=C7)C[C@@]9(SC)N(C)C([C@](COC5)(SC)N(C)C9=O)=O)C([C@]1(N(C)C3=O)CO)=O
Compound: Prodigiosin hydrochloride
SMILES: Cl.O(C=1C(N=C(C1)C=2NC=CC2)=CC=3NC(C)=C(C3)CCCCC)C
Compound: Corallopyronin C
SMILES: O=C1OC(=CC(=C1C(=O)C(/C=C/C2(OC(/C(=C\C/C=C/C)/C)CC2)C)C)O)C(CC/C=C/NC(=O)OC)C
Compound: Spectinomycin Sulfate Tetrahydrate
SMILES: S(=O)(=O)(O)O.O=C1C2(OC3C(C(O)C(NC)C(C3NC)O)OC2OC(C1)C)O.O.O.O.O
Compound: 3-oxopentanoate
SMILES: CCC(=O)CC([O-])=O
Compound: Hualyzin
SMILES: O=C(NC1=C(OC)C2=C(OC)C=C(CC(OC(=O)C)CC(=O)OCC)C=C2C(=C1)OC)NC3=C(OC)C4=C(OC)C=C(CC(OC(=O)C)CC(=O)OCC)C(=C4C=C3)OC
Compound: Spiromesifen Metabolite M01
SMILES: O=C1OC2(CCCC2)C(=C1C3=C(C=C(C)C=C3C)C)O
Compound: Cyclo(D)-Pro-(D)-Ile
SMILES: O=C1N2[C@@H](C(=O)N[C@@H]1[C@@H](CC)C)CCC2
Compound: Deacetylanisomycin
SMILES: O(C1=CC=C(CC2NCC(C2O)O)C=C1)C
Compound: Cephalosporolide H
SMILES: O=C1O[C@@H]2C[C@]3(O[C@H](CCCCCCC)CC3)O[C@@H]2C1(C)C
Compound: 17-DMAG hydrochloride
SMILES: Cl.O=C1NC=2C(=O)C(=C(NCCN(C)C)C(C2)=O)CC(CC(OC)C(O)C(C=C(C(C(C=CC=C1C)OC)OC(=O)N)C)C)C
Compound: Phenguignardic acid methyl ester
SMILES: O=C1O[C@@](C(=O)OC)(CC2=CC=CC=C2)OC1=CC3=CC=CC=C3
Compound: Nidulin
SMILES: ClC1=C2OC3=C(C(=C(OC)C(=C3C(=CC)C)Cl)C)C(OC2=C(C)C(=C1O)Cl)=O
Compound: Aranorosinol B
SMILES: O=C(N[C@@H]1[C@@H](OC2(C1)[C@H]3O[C@H]3C(O)(CC(=O)C)[C@@H]4[C@H]2O4)O)/C=C/C(=C/C(CCCCCC)C)/C
Compound: Nemadectin
SMILES: O=C1OC2CC3(OC(C(=CC(C)C)C)C(C)C(C3)O)OC(C2)CC=C(CC(C=CC=C4C5(C1C=C(C(O)C5OC4)C)O)C)C
Compound: (1S,2S)-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: Pseudoerythromycin A enol ether
SMILES: O=C1OC(C(O)(C(O)CC)C)C(C=2OC(C(C(C(C1C)OC3OC(C(O)C(C3)(OC)C)C)C)OC4OC(CC(C4O)N(C)C)C)(C)CC2C)C
Compound: Micropeptin 88-E
SMILES: O=C1O[C@@H]([C@H](NC(=O)CCC(NC(=O)[C@@H](NC(=O)CCC)CC2=CC=C(O)C=C2)C(=O)O)C(=O)N[C@H](C(=O)NC3CC[C@H](N([C@H](C(N([C@H](C(N[C@H]1[C@H](CC)C)=O)CC4=CC=CC=C4)C)=O)C(C)C)C3=O)O)CC(C)C)C
Compound: Enniatin complex
SMILES: O=C1OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(OC(C(N(C1C(CC)C)C)=O)C(C)C)=O)C(CC)C)C)C(C)C)C(CC)C)C)C(C)C.O=C1OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(OC(C(N(C1C(CC)C)C)=O)C(C)C)=O)C(C)C)C)C(C)C)C(CC)C)C)C(C)C.O=C1OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(OC(C(N(C1C(CC)C)C)=O)C(C)C)=O)C(C)C)C)C(C)C)C(C)C)C)C(C)C.O=C1OC(C(=O)N(C(C(=O)OC(C(=O)N(C(C(OC(C(N(C1C(C)C)C)=O)C(C)C)=O)C(C)C)C)C(C)C)C(C)C)C)C(C)C
Compound: Rubralide B
SMILES: O=C1O[C@H](O)C2=C1C=C(O)C(=C2O)C=O
Compound: Ivermectin B1 aglycone
SMILES: O=C1OC2CC3(OC(C(C)CC3)C(CC)C)OC(C2)CC=C(C(O)C(C=CC=C4C5(C1C=C(C(O)C5OC4)C)O)C)C
Compound: Malleobactin B
SMILES: O=C(O)[C@H](O)[C@@H](NC(=O)[C@@H](NC=O)CCCNO)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCCCCN)CCCN(O)C=O)CO
Compound: Ivermectin monosaccharide
SMILES: O=C1OC2CC3(OC(C(C)CC3)C(CC)C)OC(C2)CC=C(C(OC4OC(C(O)C(C4)OC)C)C(C=CC=C5C6(C1C=C(C(O)C6OC5)C)O)C)C
Compound: Hydroxydecylparaben
SMILES: O=C(OCC[C@@H](O)CCCCCCC)C1=CC=C(O)C=C1
Compound: Tricholomenyn D
SMILES: O=C1C(C#CC(=C)CC/C=C(/C(=O)O)\C)=C[C@@H](OC(=O)C)[C@@H]([C@H]1OC(=O)/C(=C/CCC(C#CC2=C[C@@H](OC(=O)C)[C@H]3[C@@H]([C@H]2O)O3)=C)/C)O
Compound: Nisin Z
SMILES: S1C(C(NC(=O)C(NC(=O)C2NC(=O)CNC(=O)C3CCCN3C(C(C(SC2)C)NC(=O)C4NC(=O)C(NC(=O)C(NC(=O)C(NC(C(CSC4)NC(=O)C(NC(=O)C(N)C(CC)C)=CC)=O)C(CC)C)=C)CC(C)C)=O)CCCCN)C(=O)NCC(=O)NC(C(=O)NC(CC(C)C)C(NC(C(NCC(NC(C1)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC5C(=O)NC(C(=O)NC6C(SCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)CCCCN)=C)C(C)C)CC=7NC=NC7)C(CC)C)CO)NC(C(NC(C(CSC5C)NC6=O)=O)CC(=O)N)=O)C)C)CCCCN)CCSC)CC(=O)N)=O)=O)CCSC)=O)C)C
Compound: Cavoxone
SMILES: O=C1C2=C(O[C@@H](C1)/C=C/CCC)C(=C(CO)C=C2OC)C(=O)O
Compound: Cycloechinulin
SMILES: O=C1N[C@H](C(=O)N2C1=CC=3C4=C(C=C(OC)C=C4)NC3C(C=C2)(C)C)C
Compound: 3,5-Dimethylcatechol
SMILES: OC1=C(O)C=C(C)C=C1C
Compound: Fusidienol
SMILES: O=C1C=2C(C(=O)OC)=CC(CO)=COC2OC3=C1C(O)=CC=C3
Compound: Saccharocarcin A
SMILES: O=C1OC23C(C=C(C(OC4OC(C(NC(=O)C)C(C4)(O)C)C)C(C)C=C(C5C(C(=C1C2=O)O)(C6C(C(OC7OC(C(OC8OC(C(OC9OC(C(O)C(C9)O)C)C(C8)O)C)C(C7)OC%10OC(C(O)CC%10)C)C)C(C)CC6C)C=C5)C)C)C)C=CC(C3)CC
Compound: P-Mentha-6,8-dien-2-ol acetate
SMILES: O=C(O[C@@H]1C(=CC[C@@H](C1)C(=C)C)C)C
Compound: Stachybotrylactam
SMILES: O=C1NCC2=C1C=C(O)C3=C2OC4(C5(C(C(C(O)CC5)(C)C)CCC4C)C)C3
Compound: Aldecalmycin
SMILES: O=C([C@@]1([C@@H]2[C@@H](C=C([C@@H]1C[C@H](O[C@@H]3O[C@@H]([C@@H](O)[C@@H]([C@H]3O)O)CO)[C@@H]([C@H](O)/C(=C/CC)/C)C)C)C[C@@H](C)C[C@H]2C)C)CC=O
Compound: Tetromycin A
SMILES: O=C1OC23C(C=C(CCC=C(C4C(C(=C1C2=O)O)(C5C(C(OC(=O)C)CCC5C)C=C4C)C)C)C)(C=C(C)C(C3)C)C
Compound: Tetromycin B
SMILES: O=C1OC23C(C=C(CCC=C(C4C(C(=C1C2=O)O)(C5C(C(O)CCC5C)C=C4C)C)C)C)(C=C(C)C(C3)C)C
Compound: 2-Butyl-1-azacyclohexene iminium salt
SMILES: N1=C(CCCC1)CCCC
Compound: 19,20-Epoxycytochalasin C
SMILES: O=C1C(O)(C2OC2C(OC(=O)C)C34C(=O)NC(C3C(C)=C(C(C4C=CCC1C)O)C)CC5=CC=CC=C5)C
Compound: Brabetaicicene G
SMILES: O=C1C(=C2C[C@H](O)[C@H](C)[C@H]3C(=C[C@]2([C@@H]1C)O)[C@](O)(CC3)COC)C(C)C
Compound: Camptothecin sodium
SMILES: [Na+].O=C1N2C(C3=NC4=CC=CC=C4C=C3C2)=CC(=C1CO)[C@@](O)(C(=O)[O-])CC
Compound: Curtisian H
SMILES: O=C(OC1=C(OC(=O)C[C@@H](O)C)C(=C(OC(=O)C[C@@H](O)C)C(=C1C2=CC=C(O)C=C2)OC(=O)CCC3=CC=CC=C3)C4=CC=C(O)C=C4)C[C@@H](OC(=O)C)C
Compound: Aspercolorin
SMILES: O=C1NC(C(=O)NCCC(=O)N2C(C(NC3=C1C=C(OC)C=C3)=O)CCC2)CC4=CC=CC=C4
Compound: Sulpinine A
SMILES: O1[C@H](C(=C)C)[C@H](O)[C@@H]2[C@]3([C@@H]1CC[C@]4([C@@]3(O)CC[C@@H]5[C@@]4(C=6NC=7C=C(C(C=C)(C)C)C=CC7C6C5)C)C)O2
Compound: Nornidulin
SMILES: ClC1=C2OC3=C(C(=C(O)C(=C3C(=CC)C)Cl)C)OC(C2=C(C)C(=C1O)Cl)=O
Compound: Citromycetin
SMILES: O=C1C2=C(OC(=C1)C)C3=C(C(O)=C(O)C=C3OC2)C(=O)O
Compound: TPU-0037C
SMILES: O=C1NCC(C1=C(O)C2(C3C(C=C(C2CCC(C(O)C(=CCC(O)C=CC(C(O)C=CCC(O)C=CCC(O)CC4N(C(=N)N)CCC4)C)C)C)C)C(O)CCC3)C)=O
Compound: Monosporascol A
SMILES: O=C1C2=C(O)C=C(OC)C=C2[C@@H](O)C=3C1=COC3
Compound: Ertapenem Disodium
SMILES: S(C1=C(N2C(=O)C(C2C1C)C(O)C)C(=O)[O-])C3CNC(C3)C(=O)NC4=CC(C(=O)[O-])=CC=C4.[Na+].[Na+]
Compound: Oxacyclododecindione
SMILES: ClC1=C(O)C=C(O)C2=C1CC(=O)OC(C(O)(C)CCC=C(C2=O)C)C
Compound: Cysteamine hydrochloride
SMILES: Cl.SCCN
Compound: Monensin sodium salt
SMILES: [Na+].O=C([O-])C(C(OC)C(C1OC2(OC(C3OC(C4OC(C5OC(O)(C(C)CC5C)CO)CC4C)(CC)CC3)(C)CC2)CC(C1C)O)C)C
Compound: 28-N-methylikarugamycin
SMILES: O=C1NCCC[C@@H]2N(C(=O)C(C2=O)=C(O)C=C[C@H]3[C@H](CC=C1)[C@H]4C=C[C@H]5[C@H](CC)[C@@H](C[C@@H]5[C@H]4C3)C)C
Compound: Gliorosein
SMILES: O=C1C(OC)=C(OC)C(=O)C(C1C)C
Compound: Grifolaone A
SMILES: O=C1O[C@@](O)(CC(=O)OC)C(=C1C)C
Compound: Reveromycin E
SMILES: O=C(O)/C=C(/C=C/[C@@H]1O[C@]2(O[C@@H]([C@@H](C)CC2)C/C=C(/C=C/[C@H](O)[C@H](/C=C/C(=O)O)C)\C)CC[C@]1(OC(=O)CCC(=O)O)CCCCCC)\C
Compound: Ceftriaxone sodium hydrate (2:4:7)
SMILES: S1C2N(C(C(=O)[O-])=C(C1)CSC3=NC(=O)C([O-])=NN3C)C(=O)C2NC(=O)C(=NOC)C=4N=C(N)SC4.S1C2N(C(C(=O)[O-])=C(C1)CSC3=NC(=O)C([O-])=NN3C)C(=O)C2NC(=O)C(=NOC)C=4N=C(N)SC4.[Na+].[Na+].[Na+].[Na+].O.O.O.O.O.O.O
Compound: Oximidine I
SMILES: O=C1O[C@@H](/C=C/CNC(=O)/C=C\C=N/OC)[C@@H](O)[C@@H]2O[C@@H]2C=CC=CC=3C1=C(O)C=CC3
Compound: Levofloxacin Hemihydrate
SMILES: FC1=C(N2CCN(C)CC2)C=3OCC(C)N4C3C(=C1)C(=O)C(C(=O)O)=C4.FC1=C(N2CCN(C)CC2)C=3OCC(C)N4C3C(=C1)C(=O)C(C(=O)O)=C4.O
Compound: Capnodiumone
SMILES: O=C1C(=C(C)C)C[C@@]2([C@H]([C@H](OC(=O)C)[C@H]3[C@@H](C2=C1)O3)C)C
Compound: Amidepsine G
SMILES: O=C(OC1=CC(O)=C(C(=O)N[C@H](C(=O)O)C)C(=C1)C)C2=C(O[C@H]3O[C@H]([C@H](O)[C@H]([C@@H]3O)O)CO)C=C(OC(=O)C4=C(O)C=C(OC)C=C4C)C=C2C
Compound: Aranciamycin A
SMILES: O=C1C2=C(O)C3=C(CC(O)(C)CC3OC4OC(C(O)C(C4OC)O)C)C=C2C(=O)C=5C1=C(O)C=CC5
Compound: Speciosin I
SMILES: O[C@@H]1[C@@H](C[C@H](O)CC1)CC=C(C)C
Compound: Fervenulin
SMILES: O=C1N(C(=O)C=2N=CN=NC2N1C)C
Compound: Talaroenamine B
SMILES: O=C1C(=NCC2=CC=CC=C2)C(=CC([C@]1(O)C)=O)C
Compound: Elsinochrome A
SMILES: O=C1C2=C(O)C(OC)=C3C(C(=O)C)C(C(=O)C)C=4C5=C3C2=C(C6=C5C(=C(O)C4OC)C(=O)C=C6OC)C(=C1)OC
Compound: A88696D
SMILES: O=C1O[C@@]23[C@@](C=C(C)[C@@H](C2)CC)(CCC[C@H](C[C@@H]([C@H]4[C@@]1(O4)C3=O)C)C)C
Compound: Difloxacin Hydrochloride
SMILES: Cl.FC1=C(N2CCN(C)CC2)C=C3N(C4=CC=C(F)C=C4)C=C(C(C3=C1)=O)C(=O)O
Compound: Hirsutenol B
SMILES: O=C1C=C2C[C@@]3(O)CC([C@@H]([C@H]3[C@@]2([C@H]1C)C)O)(C)C
Compound: Bactenecin
SMILES: S1SCC(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(C(NC(C(NC(C(NC(C(C1)NC(=O)C(NC(=O)C(N)CCCN=C(N)N)CC(C)C)=O)CCCN=C(N)N)=O)C(CC)C)=O)C(C)C)=O)C(C)C)C(CC)C)CCCN=C(N)N)C(C)C)C(=O)NC(C(=O)O)CCCN=C(N)N
Compound: Benquoine
SMILES: O=C1O[C@H](CCCC=CCCC=CC=C1)C
Compound: Ionomycin Calcium Salt
SMILES: [Ca+2].O=C(C=C([O-])C(CC(CC=CC(C(O)C(C(O)CC1OC(C2OC(C(O)C)(C)CC2)(C)CC1)C)C)C)C)C(CC(CC(CCC(=O)[O-])C)C)C
Compound: 4'-epi-Chaetomugilin A
SMILES: ClC1=C2C(=COC(=C2)/C=C/[C@H]([C@H](O)C)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: ATCC 20928 A
SMILES: O=CC1=C(C=C(O)C2=C1OC3(C4(C(C(C(O)CC4)(C)C)CCC3C)C)C2)C=O
Compound: Verticipyrone
SMILES: O=C1C(=C(OC(=C1C)C/C=C(/CCCCCCCC)\C)C(=O)C)C
Compound: 3-phenanthrol
SMILES: Oc1ccc2ccc3ccccc3c2c1
Compound: ATCC 20928 C
SMILES: O=CC1=C(C=C(O)C2=C1OC3(C4(C(C(C(O)CC4)(C)C)CCC3C)C)C2)CO
Compound: methyl (2,5-dihydroxy-3-nitrophenyl) acetate
SMILES: O=[N+]([O-])C1=C(O)C(=CC(=C1)O)CC(=O)OC
Compound: GE 2270A
SMILES: S1C2=NC(=C1COC)C(=O)NCC(=O)NC(C=3SC=C(N3)C=4SC=C(N4)C5=C(C6=NC(C(NC(C7=NC(C(NC2C(C)C)=O)=C(S7)C)CC(=O)NC)=O)=CS6)C=CC(=N5)C=8SC=C(N8)C=9OCC(N9)C(=O)N%10C(C(=O)N)CCC%10)C(O)C%11=CC=CC=C%11
Compound: Korormicin G
SMILES: O=C1O[C@](CC)(C)C[C@@H]1NC(=O)C[C@@H](O)/C=C\C=C\C[C@@H]2O[C@@H]2CCCCCCCC
Compound: Amonabactin T 789
SMILES: O=C(NCC(=O)NCCCCC(N)C(=O)NC(C(=O)NC(C(=O)O)CC=1C2=C(C=CC=C2)NC1)CCCCNC(=O)C3=C(O)C(O)=CC=C3)C4=C(O)C(O)=CC=C4
Compound: Banksialactone A
SMILES: O=C1OC(O)(C(C)C=2C1=C(O)C=C(OC)C2C)CO
Compound: 3-O-ethyl-lactarorufin A
SMILES: O=C1OCC2=C1C[C@](OCC)([C@H]3CC(C[C@H]3[C@@H]2O)(C)C)C
Compound: Butyrolactone V
SMILES: O=C1OC(C(=O)OC)(CC2=CC3=C(OC(C)(C)C(C3)O)C=C2)C(=C1O)C4=CC=C(O)C=C4
Compound: Adda-D-Glu(gamma)-Mdhb-D-MeAsp(beta)-L-Arg-OH
SMILES: O=C(O)[C@H](NC(=O)C(N(C(=O)[C@H](NC(=O)[C@H]([C@@H](N)/C=C/C(=C/[C@@H]([C@@H](OC)CC1=CC=CC=C1)C)/C)C)CCC(=O)O)C)C=C)[C@@H](C(=O)N[C@H](C(=O)O)CCCN=C(N)N)C
Compound: Dihydroeuphol
SMILES: OC1C(C2C(C3=C(C4(C(C(C(CCCC(C)C)C)CC4)(C)CC3)C)CC2)(C)CC1)(C)C
Compound: 3-phenanthryl sulfate
SMILES: [O-]S(=O)(=O)Oc1ccc2ccc3ccccc3c2c1
Compound: Macrosphelide L
SMILES: O=C1O[C@@H](CC(=O)O[C@H](C(=O)CCC(O[C@H]([C@@H](C=C1)O)C)=O)C)C
Compound: Dihydronovobiocin
SMILES: O=C1OC2=C(C=CC(=C2C)OC3OC(C(OC)C(C3O)OC(=O)N)(C)C)C(=C1NC(=O)C4=CC(=C(O)C=C4)CCC(C)C)O
Compound: Tianchimycin A
SMILES: O=C1O[C@@H]([C@H](C=CC=CC(=O)C(C[C@@H]([C@@H]([C@H](C=C1)C)O)C)C)C)C
Compound: Hydroaurantiogliocladin
SMILES: O(C1=C(OC)C(O)=C(C)C(=C1O)C)C
Compound: Cladospolide F
SMILES: O=C1O[C@H](CCCCCC[C@H](O)C)[C@H](C1)O
Compound: 4-Hydroxycanthin-6-one
SMILES: O=C1N2C3=C(N=CC=C3C4=C2C=CC=C4)C(=C1)O
Compound: Trichorzin PA VII
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)(CC)C)C(C)C)(C)C)CC(C)C)(C)C
Compound: N-Methylcanadium (iodide)
SMILES: [I-].O1C2=C(C=C3CC[N+]4(C(C3=C2)CC=5C=CC(=C(C5C4)OC)OC)C)OC1
Compound: Hapalonamide A
SMILES: Cl[C@H]1[C@](C=C)([C@@H]([N+]#[C-])C2C(=O)C=3C(NC=O)=CC=CC3C([C@H]2C1)(C)C)C
Compound: (-)-Mycousnine
SMILES: O=C1C(=C(O)C2(C=3C(O)=C(C)C(=C(C3OC2(C1)OC)C(=O)C)O)C)C(=O)C
Compound: Cytochalasin Z7
SMILES: O=C1O[C@@]23C(=O)N[C@H]([C@@H]2[C@H](C)C([C@H]([C@@H]3C=CC[C@@H]([C@H]([C@H](C=C1)C)O)C)O)=C)CC4=CC=CC=C4
Compound: Noracronycine
SMILES: O=C1C2=C(N(C)C3=C1C=CC=C3)C4=C(OC(C)(C)C=C4)C=C2O
Compound: 7-hydroxy-8-methoxy-3-methyl-10-oxo-10H-chromeno[3,2-c]pyridine-9-carboxylic acid
SMILES: O=C1C2=C(C(OC)=C(O)C=C2OC3=C1C=NC(=C3)C)C(=O)O
Compound: Penipurdin A
SMILES: O=C1C2=C(OC)C=C(O)C=C2C(=O)C=3C1=C(O)C=C(C[C@@H](O)C)C3
Compound: Pleosporallin D
SMILES: O=C1C([C@H]2[C@]([C@H](C(C)=CC2)C[C@@]34O[C@@H]3[C@H](O)C(=C[C@H]4O)CO)(C)CC1)(C)C
Compound: Preterramide C
SMILES: O=C(OC)C1=C(NC(=O)C2=C(NC(=O)C3=CN=CC=C3)C=CC=C2)C(OC)=C(OC)C(=C1)OC
Compound: Pyranone D
SMILES: O=C(OC)CCC[C@@H](O)C#CC#C[C@@H]1O[C@H]1CO
Compound: Remisporine B
SMILES: O=C1C2=C(OC3=C1C4C=5OC6=C(C(O)=CC(=C6)C)C(C5C7(C4C(C3)C(O)(C(=O)OC)O7)C(=O)OC)=O)C=C(C)C=C2O
Compound: Diphenylalazine B
SMILES: O=C1N[C@H](C(=O)N(C1=CC2=CC=C(O)C=C2)C)CC3=CC=CC=C3
Compound: 4'-Acetylchrysomycin C
SMILES: O=C1OC=2C=3C(C(OC)=CC2C4=C1C=C(CC)C=C4OC)=C(O)C=CC3C5OC(C(OC(=O)C)C(C5O)(O)C)C
Compound: Sansanmycin H
SMILES: S(CC[C@H](NC(=O)N[C@H](C(=O)O)CC1=CC=C(O)C=C1)C(=O)N[C@H](C(=O)N/C=C/2\O[C@@H](N3C(=O)NC(=O)C=C3)[C@@H](C2)O)[C@@H](N(C(=O)[C@@H](N)CC4=CC(O)=CC=C4)C)C)C
Compound: Nocathiacin III
SMILES: S1C/2=NC(=C1)C(=O)N[C@@H]3C=4SC=C(N4)C(=O)N[C@H](C=5SC=C(C6=C(C7=NC(C(N[C@H](C(N\C2=C(\OC)/C)=O)[C@H](O)C)=O)=CS7)C=C(O)C(=N6)C=8SC=C(N8)C(=O)NC(=O)C(=O)N)N5)COC(C9=C%10CO[C@@H]3[C@H](O)C(=O)OCC%11=C%10C(=CC=C%11)N9O)=O
Compound: Bilaid B1
SMILES: O=C(NC(C(=O)NC(C(=O)N)CC1=CC=C(O)C=C1)C(C)C)C(NC(=O)C(N)CC2=CC=CC=C2)C(C)C
Compound: Tychonamide B
SMILES: O=C/1N[C@H](C(=O)N[C@@H](C(=O)N2[C@H](C(=O)NC(C(O)C(=O)N[C@@H](C(=O)NCC(N3[C@H](C(N4[C@@H](C(N[C@@H](C(N[C@H](C(N\C1=C\C)=O)CO)=O)[C@H](CC)C)=O)CCC4)=O)CCC3)=O)CCC(=O)N)CC(OC(=O)[C@@H](N(C(=O)C)C)CC(C)C)CC(O)CC5=CC=CC=C5)CCC2)CCC6=CC=CC=C6)[C@H](O)C
Compound: Bilaid C1
SMILES: O=C(NC(C(=O)NC(C(=O)N)CC1=CC=CC=C1)C(C)C)C(NC(=O)C(N)CC2=CC=C(O)C=C2)C(C)C
Compound: Burnettramic acid A aglycone
SMILES: O=C1N2C(CC(C2)O)C(C1=C(O)C(CC(CCCCCCCC=CCC(O)CCCC(O)CCCCCCCO)C)C)=O
Compound: 3097-C2
SMILES: O=C(O[C@@H]1[C@@H](O)CN[C@H]1CC2=CC=C(O)C=C2)C
Compound: Glioroseinol
SMILES: O=C1C(OC)=C(OC)C(O)C(C1C)C
Compound: WIN 66306
SMILES: O=C1N2[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(N[C@H](C(NCC(N[C@H]1CC=3C4=C(C=CC=C4)NC3)=O)=O)C(O)C5=CC(=C(O)C=C5)CC=C(C)C)=O)C(C)C)CCC2
Compound: Onychocin B
SMILES: O=C1N(C(C(=O)NC(C(=O)N(C(C(NC1C(CC)C)=O)CC2=CC=CC=C2)C)C(C)C)CC3=CC=CC=C3)C
Compound: Siastatin B
SMILES: O=C(O)[C@@H]1[C@H](O)[C@H](O)[C@@H](NC(=O)C)NC1
Compound: Marinopyrrole C
SMILES: ClC1=CC(=C(O)C=C1)C(=O)C=2NC(Cl)=C(C2N3C(Cl)=C(Cl)C=C3C(=O)C4=C(O)C=CC=C4)Cl
Compound: Epiphorellic acid 2
SMILES: O=C(OC)C1=C(OC2=C(OC)C=C(O)C(=C2CCCCC)C(=O)O)C=C(O)C=C1CCC(=O)CC
Compound: Epiphorellic acid 1
SMILES: O=C(OC)C1=C(OC2=C(OC)C=C(O)C(=C2CCCCC)C(=O)O)C=C(O)C=C1CCCCC
Compound: Terfestatin C
SMILES: O=C(O)C=1O[C@@H](OC2=C(O)C(=C(O)C=C2C3=CC=CC=C3)C4=CC=CC=C4)[C@H](O)[C@H](C1)O
Compound: Anominine
SMILES: OC1C2(C(C(C)CC1)(CCC(C2CC=3C4=C(C=CC=C4)NC3)=C)C)CCC=C(C)C
Compound: Gloeosporioidiol
SMILES: O(C1=CC=C([C@@H](O)CO)C=C1)C
Compound: Sescandelin B
SMILES: O=C1OC(=C(CO)C=2C1=C(O)C=C(O)C2)C
Compound: Roseopurpurin G
SMILES: O=C1OC2=C(C(=C(O)C(=C2C)O)C)OC3=C1C(=CC(=C3C)O)C
Compound: Lasiojasmonate C
SMILES: O=C1O[C@H](C)[C@H]([C@@H]1C)CO[C@H]2O[C@H](C)[C@H]([C@@H]2C)COC(=O)C[C@@H]3[C@H](C(=O)CC3)C/C=C\CC
Compound: Verlamelin
SMILES: O=C1OC(CCCC(=O)NC(C(=O)NC(C(=O)N2C(C(NC(C(NC(C(NC1C(C)C)=O)CC3=CC=C(O)C=C3)=O)CCC(=O)N)=O)CCC2)C)C(O)C)CCCCCCCCC
Compound: Nikkomycin Lz
SMILES: O=C1N(C=CC(N1)=O)C2OC(C(NC(=O)C(N)C(C(O)C3=NC=CC=C3)C)C(=O)O)C(C2O)O
Compound: Wailupemycin F
SMILES: O=C1OC(C2=C(C3=CC=CC=C3)C=C(O)C4=C2C[C@H](O)CC4=O)=CC(=C1)O
Compound: 1alpha,10alpha-epoxy-13-hydroxyeremophil-7(11)-en-12,8beta-olide
SMILES: O=C1O[C@@H]2C[C@]34O[C@H]3CC[C@@H]([C@]4(CC2=C1CO)C)C
Compound: Piericidin C4
SMILES: O=C1C(OC)=C(OC)NC(=C1C)CC=C(CC(=CC(=CC(C(O)C2(OC2C(C)C)C)C)C)C)C
Compound: 7-isopropenylbicyclo[4.2.0]octa-1,3,5-triene-2,5-diol,5-beta-D-glucopyranoside
SMILES: O1[C@@H](OC2=C3C(=C(O)C=C2)CC3C(=C)C)[C@H](O)[C@@H](O)[C@@H]([C@H]1CO)O
Compound: Chaetoglobocin L
SMILES: O=C1C=CC(=O)C(O)C(=CC(CC=CC2C13C(=O)NC(C3C(CC)C(C2O)=C)C(C=4C5=C(C=CC=C5)NC4)C)C)C
Compound: Engyodontiumone J
SMILES: O=C(O)C1=CC(O)=C(/C(=C\CCC(O)(C)C)/C)C=C1
Compound: Magainin I
SMILES: S(CCC(NC(=O)C(NC(=O)C(NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC(=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)CNC(=O)C(NC(=O)CN)C(CC)C)CCCCN)CC1=CC=CC=C1)CC(C)C)CC=2NC=NC2)CO)C)CCCCN)CC3=CC=CC=C3)CCCCN)C)CC4=CC=CC=C4)C(C)C)CCC(=O)O)C(CC)C)C(=O)NC(C(=O)NC(C(=O)O)CO)CCCCN)C
Compound: (3R)-7-(3,7-dimethoxy-1,3-dihydro-2-benzouran-1-yl)-3-hydroxy-3-methyl-2,4-dihydronaphthalen-1-one
SMILES: O=C1C2=C(C=CC(=C2)C3OC(OC)C=4C3=C(OC)C=CC4)C[C@](C1)(O)C
Compound: Dimethachlor Metabolite SYN 530561
SMILES: O=C(O)C1=C(N(C(=O)CO)CCOC)C(=CC=C1)C
Compound: Penicibrocazine B
SMILES: S([C@@]12N(C(=O)[C@@H]3C[C@H]4[C@@H](N3C1=O)[C@H](O)CCC4=O)[C@@H]5[C@@H](O)C=CC=C5C2)C
Compound: 1,10-Phenanthroline monohydrochloride monohydrate
SMILES: Cl.O.N=1C2=C3N=CC=CC3=CC=C2C=CC1
Compound: 2,8-dimethoxy-1,6-dimethoxycarbonyl-xanthen-9-one
SMILES: O=C1C2=C(C(OC)=CC=C2OC3=C1C(OC)=CC(=C3)C(=O)OC)C(=O)OC
Compound: Morantel (+)-tartrate salt
SMILES: S1C(=C(C)C=C1)C=CC2=NCCCN2C.O=C(O)C(O)C(O)C(=O)O
Compound: [(4E,10E)-13,19,20-trihydroxy-8,14-dimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(22),4,10,18,20-pentaen-9-yl] carbamate
SMILES: O=C1NC2=CC(O)=C(O)C(=C2)CC(CC(OC)C(O)C(C=C(C(C(CCC=C1C)OC)OC(=O)N)C)C)C
Compound: Exophilin A
SMILES: O=C(O[C@@H](C[C@@H](O)CC(=O)O)CCCCC)C[C@H](O)C[C@H](OC(=O)C[C@H](O)C[C@H](O)CCCCC)CCCCC
Compound: APHE-3
SMILES: O=C1N2NC=C(C2=CC3=C1C=CC=C3)C
Compound: 2a,8a-epoxy-epi-deacetylgriseusin B
SMILES: O=C1C2=C(O)C=CC=C2C(=O)[C@@]34[C@@]1(O3)[C@]5(O[C@H](CC(=O)O)C4)O[C@@H](C[C@@H]([C@H]5O)O)C
Compound: Cyclo-(L-Ile-L-Leu-L-Leu-L-Leu-L-Leu)
SMILES: O=C1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@H](C(N[C@H]1[C@H](CC)C)=O)CC(C)C)=O)CC(C)C)CC(C)C)CC(C)C
Compound: Trans-1-hydroxy-3-(4-hydroxyphenyl)-4-isobutylpyrrolidine-2,5-dione
SMILES: O=C1N(O)C(=O)[C@@H]([C@H]1C2=CC=C(O)C=C2)CC(C)C
Compound: Cephalosporolide G
SMILES: O=C1O[C@@H](CCC(=O)C[C@H]([C@H](C1)O)O)C
Compound: [(1S,8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methyl octadeca-9,12-dienoate
SMILES: O=C(OC[C@H]1C(=CCC2[C@@]1(CCCC2(C)C)C)C)CCCCCCCC=CCC=CCCCCC
Compound: RES-701-2
SMILES: O=C1N2C(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)O)CC=3C4=C(C(O)=CC=C4)NC3)CC5=CC=C(O)C=C5)CC6=CC=C(O)C=C6)CC(=O)N)CC7=CC=CC=C7)CC8=CC=CC=C8)CC=9C%10=C(C=CC=C%10)NC9)CC(=O)NCC(=O)NC(C(=O)NC(C(NC(C(NCC(NC(C(NC1C)=O)[C@H](O)C)=O)=O)CC=%11N=CNC%11)=O)CC=%12C%13=C(C=CC=C%13)NC%12)CC(=O)N)CCC2
Compound: 10-Phenyl-[12]-cytochalasin Z16
SMILES: O=C1C(=CCC(=O)O[C@]23C(=O)N[C@H]([C@@H]2[C@H](C)C([C@H]([C@@H]3C=CC[C@@H]1C)O)=C)CC4=CC=CC=C4)C
Compound: Yicathin C
SMILES: O=C1C2=C(OC3=C1C(O)=CC(=C3)C)C=C(C(=O)O)C=C2OC
Compound: Trichodin A
SMILES: O=C1NC=C(C2=CC=C(O)C=C2)C3=C1[C@H]4[C@@H](C[C@H](C)C[C@@H]4C)[C@@H](O3)C
Compound: Heptadec-11-enoic acid
SMILES: O=C(O)CCCCCCCCCC=CCCCCC
Compound: 19,20-epoxy-cytochalasin C
SMILES: O=C1[C@](O)([C@@H]2O[C@H]2[C@@H](OC(=O)C)[C@@]34C(=O)N[C@H]([C@H]3C(C)=C([C@H]([C@@H]4C=CC[C@@H]1C)O)C)CC5=CC=CC=C5)C
Compound: Gavibamycin B3
SMILES: O=C(OC1C(O)CC(OC2C(O)CC3(OC4(CC(OC5C(OC)C(OC(C5O)OC6C(O)C(OC)C(OC7OCC8OC9(OC8C7OC(=O)C(C)C)OC(C(O)(C(O)C)C%10C9OCO%10)C)OC6COC)C)OC(C4O3)C)C)OC2C)OC1C)C%11=C(O)C=C(O)C=C%11C
Compound: Variecolorin J
SMILES: O=C1NC(O)=C(C=C2C3=C(C=CC(=C3)CC=C(C)C)N=C2C(C=C)(C)C)NC1=O
Compound: 1,5-dihydroxy-3,4-dimethoxy-2-methylanthraquinone
SMILES: O=C1C2=C(OC)C(OC)=C(C)C(=C2C(=O)C=3C1=C(O)C=CC3)O
Compound: 5,7-Dimethoxy-4-phenylcoumarin
SMILES: O=C1OC2=C(C(OC)=CC(=C2)OC)C(=C1)C3=CC=CC=C3
Compound: Daedaleanic acid A
SMILES: O=C(O)[C@@H]([C@@H]1[C@@]2([C@@](C3=C(C(=C(C)C=C3)CCC(=O)C(C)C)CC2)(C)C[C@H]1O)C)CCC(=C)C(C)C
Compound: 1,8-dimethoxynaphthalen-2-ol
SMILES: O(C=1C2=C(OC)C=CC=C2C=CC1O)C
Compound: [(2S,3S,4S,5R,6S)-6-[(2S)-2,3-di(hexadecanoyloxy)propoxy]-4,5-di(hexadecanoyloxy)-3-hydroxy-tetrahydropyran-2-yl]methanesulfonic acid
SMILES: S(=O)(=O)(O)CC1OC(OC[C@@H](OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)C(OC(=O)CCCCCCCCCCCCCCC)C(C1O)OC(=O)CCCCCCCCCCCCCCC
Compound: Ichthyopeptin B
SMILES: O=C1O[C@@H]([C@H](NC(=O)[C@@H](NC(=O)C(O)CC2=CC=C(O)C=C2)CC(=O)N)C(=O)N[C@H](C(=O)N[C@H]3CC[C@H](N([C@H](C(N(C(C(N[C@H]1C(C)C)=O)CC4=CC=CC=C4)C)=O)[C@H](CC)C)C3=O)O)CC(C)C)C
Compound: Cylindrol A5
SMILES: ClC1=C(O)C(=C(O)C(=C1C)C=O)C/C=C(/[C@H](OC(=O)CCC)C[C@]2([C@@H](C(=O)CC[C@@H]2C)C)C)\C
Compound: Conioxepinol D
SMILES: O=C1OC=C[C@H]([C@@]2(C1=C(O)C3=C(C=C(C)C=C3O)O2)C(=O)OC)O
Compound: Epi-aszonalenin B
SMILES: O=C1N2[C@H]3N(C=4C=CC=CC4[C@@]3(C(C=C)(C)C)C[C@H]2C(=O)NC5=C1C=CC=C5)C=O
Compound: 11alpha-hydroxy-3,7-dioxo-5alpha-lanosta-8,24(E)-dien-26-oic acid
SMILES: O=C1C2=C([C@]3(CCC(C([C@@H]3C1)(C)C)=O)C)[C@H](O)C[C@]4([C@]2(CC[C@@H]4[C@@H](CC/C=C(/C(=O)O)\C)C)C)C
Compound: 19,20-Epoxycytochalasin Q
SMILES: O=C1[C@](O)([C@@H]2O[C@H]2[C@@H](OC(=O)C)[C@@]34C(=O)N[C@H]([C@@H]3[C@H](C)[C@@]5([C@H]([C@@H]4C=CC[C@@H]1C)O5)C)CC6=CC=CC=C6)C
Compound: Carbazomycin A
SMILES: O(C1=C(OC)C2=C(NC3=C2C=CC=C3)C(=C1C)C)C
Compound: (N-[9,10-dihydro-7-iso-jasmonoyl]-(S)-isoleucine
SMILES: O=C1[C@H]([C@@H](CC(=O)NC(C(=O)O)C(CC)C)CC1)CCCCC
Compound: N-desmethylpretubulysin D
SMILES: S1C(=NC(=C1)C(=O)N[C@@H](CC2=CC=C(O)C=C2)C[C@@H](C(=O)O)C)CC[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]3N(CCCC3)C)[C@H](CC)C)C(C)C
Compound: Cyclo(4-hydroxy-S-Pro-S-Trp)
SMILES: O=C1N2[C@H](C(=O)N[C@H]1CC=3C4=C(C=CC=C4)NC3)CC(C2)O
Compound: Altersolanol Q
SMILES: O=C1C2=C(C(O)=CC(=C2)OC)[C@@H](O)[C@@H]3[C@@H]1C[C@@](O)(C)[C@@H](C3)O
Compound: Arisugacin H
SMILES: O=C1OC(C2=CC=C(OC)C=C2)=CC3=C1C[C@]4(O)[C@@]5([C@](O)(C([C@H](OC(=O)C)C[C@@H]5O)(C)C)CC[C@]4(O3)C)C
Compound: Diepoxin G
SMILES: O=C1[C@]23O[C@@]2([C@@H](O)[C@H](C1)O)[C@@H](O)[C@@H]4[C@H](C35OC=6C=7C(C=CC6)=CC=CC7O5)O4
Compound: (E)-9-etheno-lasiodiplodin
SMILES: O=C1O[C@H](CCCCCC=CC=2C1=C(OC)C=C(O)C2)C
Compound: Teicoplanin product I
SMILES: ClC1=C2OC3=C(OC4OC(C(O)C(C4NC(=O)CC/C=C/C/C=C/CC)O)CO)C=5OC6=C(Cl)C=C(CC7NC(=O)C(N)C=8C=CC(=C(OC=9C=C(C(C(NC(C(=C3)C5)C(=O)NC%10C(NC(C(C(=C1)C=C2)OC%11OC(C(O)C(C%11NC(=O)C)O)CO)C(=O)NC(C%12=C(C(OC%13OC(C(O)C(C%13O)O)CO)=CC(=C%12)O)C=%14C=C%10C=CC%14O)C(=O)O)=O)=O)NC7=O)C=C(O)C9)C8)O)C=C6
Compound: 10-dehydroxymelleolide D
SMILES: ClC1=C(OC)C=C(O)C(=C1C)C(=O)O[C@H]2[C@@]3(O)C(=C[C@]4(O)CC(C[C@@H]4[C@@]3(C)C2)(C)C)CO
Compound: 3-hydroxy-6-dimethylallylindolin (DMAIN)-2-one
SMILES: O=C1NC=2C=C(CC=C(C)C)C=CC2[C@H]1O
Compound: 4-methoxy-2,5-diphenylbenzene-1,3-diol
SMILES: O(C1=C(O)C(=C(O)C=C1C2=CC=CC=C2)C3=CC=CC=C3)C
Compound: Microsphaerophthalide B
SMILES: O=C1OCC=2C1=C(O)C(=C(OC)C2C=O)C
Compound: Nocatrione B
SMILES: O=C1C2=C(O)C=3C(=CC(O)=C(C3C)C=4OC(=O)C=C(C4)O)C=C2C(=O)C=5C1=C(O)C=C(O)C5
Compound: Mildiomycin
SMILES: O=C1N=C(N)C(CO)=CN1[C@@H]2O[C@H](C(O)(C(=O)O)CC(O)CN=C(N)N)[C@@H](NC(=O)C(N)CO)C=C2
Compound: Pericosine B
SMILES: O=C(OC)C1=C[C@H](O)[C@H](O)[C@@H]([C@@H]1OC)O