CAS RN: 131985-08-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H48O2
MOLECULAR WEIGHT: 440.70092
SMILES: CC(C)[C@@]12CC[C@]3([C@@]1(O2)CC[C@@]4([C@@H]3CC[C@H]5[C@]4(CC[C@@H]6[C@@]5(CCC(=O)C6(C)C)C)C)C)C
Structure:
CAS RN: 132943-52-3
CAS Name: 3-ethyl-1-formyl-8-methoxy-4-oxo-7,12-dihydro-6H-indolo[2,3-a]quinolizine-2-carboxylic acid methyl ester
OPENEYE Name: methyl 3-ethyl-1-formyl-8-methoxy-4-oxo-7,12-dihydro-6H-indolo[2,3-a]quinolizine-2-carboxylate
IUPAC Name: methyl 3-ethyl-1-formyl-8-methoxy-4-oxo-7,12-dihydro-6H-indolo[2,3-a]quinolizine-2-carboxylate
SYSTEMATIC NAME: methyl 3-ethyl-1-methanoyl-8-methoxy-4-oxidanylidene-7,12-dihydro-6H-indolo[2,3-a]quinolizine-2-carboxylate
MOLECULAR FORMULA: C21H20N2O5
MOLECULAR WEIGHT: 380.3939
SMILES: CCC1=C(C(=C2C3=C(CCN2C1=O)C4=C(N3)C=CC=C4OC)C=O)C(=O)OC
Structure:
CAS RN: 302-27-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C34H47NO11
MOLECULAR WEIGHT: 645.73708
SMILES: CCN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H]([C@H]31)[C@@]5([C@H]6[C@@H]4C[C@]([C@@H]6OC(=O)C7=CC=CC=C7)([C@H]([C@@H]5O)OC)O)OC(=O)C)OC)OC)O)COC
Structure:
CAS RN: 16859-59-9
CAS Name: (3R)-3-hydroxy-3H-isobenzofuran-1-one
OPENEYE Name: (3R)-3-hydroxy-3H-isobenzofuran-1-one
IUPAC Name: (3R)-3-hydroxy-3H-2-benzofuran-1-one
SYSTEMATIC NAME: (3R)-3-oxidanyl-3H-2-benzofuran-1-one
MOLECULAR FORMULA: C8H6O3
MOLECULAR WEIGHT: 150.13144
SMILES: C1=CC=C2C(=C1)[C@@H](OC2=O)O
Structure:
CAS RN: 17587-33-6
CAS Name: (2E,6E)-nona-2,6-dienal
OPENEYE Name: (2E,6E)-nona-2,6-dienal
IUPAC Name: (2E,6E)-nona-2,6-dienal
SYSTEMATIC NAME: (2E,6E)-nona-2,6-dienal
MOLECULAR FORMULA: C9H14O
MOLECULAR WEIGHT: 138.20686
SMILES: CC/C=C/CC/C=C/C=O
Structure:
CAS RN: 15527-86-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H24N2O2
MOLECULAR WEIGHT: 312.40606
SMILES: CC1C(C2CC3N1C(C2CO)CC4=C3NC5=CC=CC=C45)CO
Structure:
CAS RN: 34298-85-6
CAS Name: 1,8-dihydroxy-3-methyl-6-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]anthracene-9,10-dione
OPENEYE Name: 1,8-dihydroxy-3-methyl-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-anthracene-9,10-dione
IUPAC Name: 1,8-dihydroxy-3-methyl-6-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyanthracene-9,10-dione
SYSTEMATIC NAME: 3-[(2R,3R,4S,5R,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-6-methyl-1,8-bis(oxidanyl)anthracene-9,10-dione
MOLECULAR FORMULA: C21H20O10
MOLECULAR WEIGHT: 432.3775
SMILES: CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O[C@@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O)O)O
Structure:
CAS RN: 901-93-9
CAS Name: acetic acid [(8R,9S,13R,14R)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
OPENEYE Name: [(8R,9S,13R,14R)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] acetate
IUPAC Name: [(8R,9S,13R,14R)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] acetate
SYSTEMATIC NAME: [(8R,9S,13R,14R)-13-methyl-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ethanoate
MOLECULAR FORMULA: C20H24O3
MOLECULAR WEIGHT: 312.40276
SMILES: CC(=O)OC1=CC2=C(C=C1)[C@H]3CC[C@@]4([C@@H]([C@@H]3CC2)CCC4=O)C
Structure:
CAS RN: 39765-72-5
CAS Name: (4aS,5S,8aS)-3-methyl-8-methylene-5-propan-2-yl-1,4a,5,6,7,8a-hexahydronaphthalen-2-one
OPENEYE Name: (4aS,5S,8aS)-5-isopropyl-3-methyl-8-methylene-1,4a,5,6,7,8a-hexahydronaphthalen-2-one
IUPAC Name: (4aS,5S,8aS)-3-methyl-8-methylidene-5-propan-2-yl-1,4a,5,6,7,8a-hexahydronaphthalen-2-one
SYSTEMATIC NAME: (4aS,5S,8aS)-3-methyl-8-methylidene-5-propan-2-yl-1,4a,5,6,7,8a-hexahydronaphthalen-2-one
MOLECULAR FORMULA: C15H22O
MOLECULAR WEIGHT: 218.33458
SMILES: CC1=C[C@@H]2[C@@H](CCC(=C)[C@H]2CC1=O)C(C)C
Structure:
CAS RN: 78092-22-5
CAS Name: (3aS,6R,6aS,10aS)-6,9-dimethyl-3-methylene-4,5,6,6a,7,8-hexahydro-3aH-benzo[h]benzofuran-2-one
OPENEYE Name: (3aS,6R,6aS,10aS)-6,9-dimethyl-3-methylene-4,5,6,6a,7,8-hexahydro-3aH-benzo[h]benzofuran-2-one
IUPAC Name: (3aS,6R,6aS,10aS)-6,9-dimethyl-3-methylidene-4,5,6,6a,7,8-hexahydro-3aH-benzo[h][1]benzofuran-2-one
SYSTEMATIC NAME: (3aS,6R,6aS,10aS)-6,9-dimethyl-3-methylidene-4,5,6,6a,7,8-hexahydro-3aH-benzo[h][1]benzofuran-2-one
MOLECULAR FORMULA: C15H20O2
MOLECULAR WEIGHT: 232.3181
SMILES: C[C@@H]1CC[C@H]2C(=C)C(=O)O[C@]23[C@H]1CCC(=C3)C
Structure:
CAS RN: 441334-14-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H26O6
MOLECULAR WEIGHT: 350.40614
SMILES: C[C@H]1[C@@H]2[C@@H]([C@@H]3[C@@]4([C@@H](CC(=O)[C@]3([C@H]1C(=O)O2)C)C(=C[C@@H]([C@H]4O)O)C)C)O
Structure:
CAS RN: 25436-90-2
CAS Name: (E)-5-[(1S,2S,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methyl-2-pentenoic acid
OPENEYE Name: (E)-5-[(1S,2S,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methyl-pent-2-enoic acid
IUPAC Name: (E)-5-[(1S,2S,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid
SYSTEMATIC NAME: (E)-5-[(1S,2S,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methyl-pent-2-enoic acid
MOLECULAR FORMULA: C20H32O2
MOLECULAR WEIGHT: 304.46688
SMILES: C[C@H]1CC[C@@]2([C@@H]([C@@]1(C)CC/C(=C/C(=O)O)/C)CCC=C2C)C
Structure:
CAS RN: 18473-68-2
CAS Name: 4-methoxy-3-(2,3,4-trimethoxy-6-methoxycarbonylphenyl)-2-phenazinecarboxylic acid methyl ester
OPENEYE Name: methyl 4-methoxy-3-(2,3,4-trimethoxy-6-methoxycarbonyl-phenyl)phenazine-2-carboxylate
IUPAC Name: methyl 4-methoxy-3-(2,3,4-trimethoxy-6-methoxycarbonylphenyl)phenazine-2-carboxylate
SYSTEMATIC NAME: methyl 4-methoxy-3-(2,3,4-trimethoxy-6-methoxycarbonyl-phenyl)phenazine-2-carboxylate
MOLECULAR FORMULA: C26H24N2O8
MOLECULAR WEIGHT: 492.47736
SMILES: COC1=C(C(=C(C(=C1)C(=O)OC)C2=C(C3=NC4=CC=CC=C4N=C3C=C2C(=O)OC)OC)OC)OC
Structure:
CAS RN: 83140-64-1
CAS Name: (2R,3aR,5R,6S,8Z,10aR)-6-bromo-2-(3-bromopropa-1,2-dienyl)-5-ethyl-2,3,3a,5,6,7,10,10a-octahydrofuro[3,2-b]oxonin
OPENEYE Name: (2R,3aR,5R,6S,8Z,10aR)-6-bromo-2-(3-bromopropa-1,2-dienyl)-5-ethyl-2,3,3a,5,6,7,10,10a-octahydrofuro[3,2-b]oxonine
IUPAC Name: (2R,3aR,5R,6S,8Z,10aR)-6-bromo-2-(3-bromopropa-1,2-dienyl)-5-ethyl-2,3,3a,5,6,7,10,10a-octahydrofuro[3,2-b]oxonine
SYSTEMATIC NAME: (2R,3aR,5R,6S,8Z,10aR)-6-bromanyl-2-(3-bromanylpropa-1,2-dienyl)-5-ethyl-2,3,3a,5,6,7,10,10a-octahydrofuro[3,2-b]oxonine
MOLECULAR FORMULA: C15H20Br2O2
MOLECULAR WEIGHT: 392.1261
SMILES: CC[C@@H]1[C@H](C/C=C\C[C@@H]2[C@H](O1)C[C@@H](O2)C=C=CBr)Br
Structure:
CAS RN: 11075-15-3
CAS Name: 1-[2-hydroxy-4-methoxy-6-[[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]phenyl]-3-(4-hydroxyphenyl)-1-propanone
OPENEYE Name: 1-[2-hydroxy-4-methoxy-6-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-phenyl]-3-(4-hydroxyphenyl)propan-1-one
IUPAC Name: 1-[2-hydroxy-4-methoxy-6-[(2S,3R,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-3-(4-hydroxyphenyl)propan-1-one
SYSTEMATIC NAME: 1-[2-[(2S,3R,4R,5S,6S)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4-methoxy-6-oxidanyl-phenyl]-3-(4-hydroxyphenyl)propan-1-one
MOLECULAR FORMULA: C22H26O10
MOLECULAR WEIGHT: 450.43584
SMILES: COC1=CC(=C(C(=C1)O[C@H]2[C@@H]([C@@H]([C@@H]([C@@H](O2)CO)O)O)O)C(=O)CCC3=CC=C(C=C3)O)O
Structure:
CAS RN: 25924-78-1
CAS Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-(1-pyrrolidinyl)-1-penta-2,4-dienone
OPENEYE Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-penta-2,4-dien-1-one
IUPAC Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-ylpenta-2,4-dien-1-one
SYSTEMATIC NAME: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-penta-2,4-dien-1-one
MOLECULAR FORMULA: C16H17NO3
MOLECULAR WEIGHT: 271.31108
SMILES: C1CCN(C1)C(=O)/C=C/C=C/C2=CC3=C(C=C2)OCO3
Structure:
CAS RN: 54976-54-4
CAS Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-(1-pyrrolidinyl)-1-penta-2,4-dienone
OPENEYE Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-penta-2,4-dien-1-one
IUPAC Name: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-ylpenta-2,4-dien-1-one
SYSTEMATIC NAME: (2E,4E)-5-(1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-penta-2,4-dien-1-one
MOLECULAR FORMULA: C16H17NO3
MOLECULAR WEIGHT: 271.31108
SMILES: C1CCN(C1)C(=O)/C=C/C=C/C2=CC3=C(C=C2)OCO3
Structure:
CAS RN: 51095-49-9
CAS Name: 1,2-dimethoxy-4-[2-(3-methoxyphenyl)ethyl]benzene
OPENEYE Name: 1,2-dimethoxy-4-[2-(3-methoxyphenyl)ethyl]benzene
IUPAC Name: 1,2-dimethoxy-4-[2-(3-methoxyphenyl)ethyl]benzene
SYSTEMATIC NAME: 1,2-dimethoxy-4-[2-(3-methoxyphenyl)ethyl]benzene
MOLECULAR FORMULA: C17H20O3
MOLECULAR WEIGHT: 272.3389
SMILES: COC1=C(C=C(C=C1)CCC2=CC(=CC=C2)OC)OC
Structure:
CAS RN: 915-32-2
CAS Name: (1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylic acid methyl ester
OPENEYE Name: methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
IUPAC Name: methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
SYSTEMATIC NAME: methyl (1S,2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-1,2,6a,6b,9,9,12a-heptamethyl-10-oxidanyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a-carboxylate
MOLECULAR FORMULA: C31H50O3
MOLECULAR WEIGHT: 470.7269
SMILES: C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C(=O)OC
Structure:
CAS RN: 487010-46-8
CAS Name: (2S)-2-(2,2-dimethyl-1-benzopyran-6-yl)-7-hydroxy-6-(3-methylbut-2-enyl)-3,4-dihydro-2H-1-benzopyran-4-one
OPENEYE Name: (2S)-2-(2,2-dimethylchromen-6-yl)-7-hydroxy-6-(3-methylbut-2-enyl)chroman-4-one
IUPAC Name: (2S)-2-(2,2-dimethylchromen-6-yl)-7-hydroxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one
SYSTEMATIC NAME: (2S)-2-(2,2-dimethylchromen-6-yl)-6-(3-methylbut-2-enyl)-7-oxidanyl-2,3-dihydrochromen-4-one
MOLECULAR FORMULA: C25H26O4
MOLECULAR WEIGHT: 390.47154
SMILES: CC(=CCC1=C(C=C2C(=C1)C(=O)C[C@H](O2)C3=CC4=C(C=C3)OC(C=C4)(C)C)O)C
Structure:
CAS RN: 72050-71-6
CAS Name: (2R,3S,5S,8R,9R,10R,13S,14S,17R)-17-[(2S,3R,4R,5R)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
OPENEYE Name: (2R,3S,5S,8R,9R,10R,13S,14S,17R)-17-[(1S,2R,3R,4R)-2,3-dihydroxy-1,4,5-trimethyl-hexyl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
IUPAC Name: (2R,3S,5S,8R,9R,10R,13S,14S,17R)-17-[(2S,3R,4R,5R)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
SYSTEMATIC NAME: (2R,3S,5S,8R,9R,10R,13S,14S,17R)-17-[(2S,3R,4R,5R)-5,6-dimethyl-3,4-bis(oxidanyl)heptan-2-yl]-10,13-dimethyl-2,3-bis(oxidanyl)-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one
MOLECULAR FORMULA: C28H48O5
MOLECULAR WEIGHT: 464.67772
SMILES: C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@@H]3[C@@H]2CC(=O)[C@@H]4[C@@]3(C[C@H]([C@H](C4)O)O)C)C)[C@H]([C@@H]([C@H](C)C(C)C)O)O
Structure:
CAS RN: 105762-16-1
CAS Name: (2S,3R,4S,5R,6S)-6-[[(3S,4S,4aR,6aR,6bS,8aS,12aR,14aR,14bR)-8a-carboxy-4-formyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid
OPENEYE Name: (2S,3R,4S,5R,6S)-6-[[(3S,4S,4aR,6aR,6bS,8aS,12aR,14aR,14bR)-8a-carboxy-4-formyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
IUPAC Name: (2S,3R,4S,5R,6S)-6-[[(3S,4S,4aR,6aR,6bS,8aS,12aR,14aR,14bR)-8a-carboxy-4-formyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
SYSTEMATIC NAME: (2S,3R,4S,5R,6S)-6-[[(3S,4S,4aR,6aR,6bS,8aS,12aR,14aR,14bR)-8a-carboxy-4-methanoyl-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-tris(oxidanyl)oxane-2-carboxylic acid
MOLECULAR FORMULA: C36H54O10
MOLECULAR WEIGHT: 646.80796
SMILES: C[C@]12CC[C@@H]([C@@]([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C=O)O[C@@H]6[C@@H]([C@H]([C@H]([C@H](O6)C(=O)O)O)O)O
Structure:
CAS RN: 515-00-4
CAS Name: [(1R,5S)-6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methanol
OPENEYE Name: [(1R,5S)-6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methanol
IUPAC Name: [(1R,5S)-6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methanol
SYSTEMATIC NAME: [(1R,5S)-6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enyl]methanol
MOLECULAR FORMULA: C10H16O
MOLECULAR WEIGHT: 152.23344
SMILES: CC1([C@@H]2CC=C([C@H]1C2)CO)C
Structure:
CAS RN: 4344-84-7
CAS Name: (2S)-5-oxo-2-oxolanecarboxylic acid
OPENEYE Name: (2S)-5-oxotetrahydrofuran-2-carboxylic acid
IUPAC Name: (2S)-5-oxooxolane-2-carboxylic acid
SYSTEMATIC NAME: (2S)-5-oxidanylideneoxolane-2-carboxylic acid
MOLECULAR FORMULA: C5H6O4
MOLECULAR WEIGHT: 130.09874
SMILES: C1CC(=O)O[C@@H]1C(=O)O
Structure:
CAS RN: 564-16-9
CAS Name: (2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
OPENEYE Name: (2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
IUPAC Name: (2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
SYSTEMATIC NAME: (2R,4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-2,4a,6a,6b,9,9,12a-heptamethyl-10-oxidanyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
MOLECULAR FORMULA: C30H48O3
MOLECULAR WEIGHT: 456.70032
SMILES: C[C@]12CC[C@@](C[C@@H]1C3=CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)(C)C(=O)O
Structure:
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