CAS RN: 66934-60-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C29H47NO3
MOLECULAR WEIGHT: 457.68838
SMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)OC(=O)C)C)C)C)NC1
Structure:
CAS RN: 79464-64-5
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C27H45NO2
MOLECULAR WEIGHT: 415.6517
SMILES: CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)NC1
Structure:
CAS RN: 474-62-4
CAS Name: 17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
OPENEYE Name: 10,13-dimethyl-17-(1,4,5-trimethylhexyl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
IUPAC Name: 17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SYSTEMATIC NAME: 17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
MOLECULAR FORMULA: C28H48O
MOLECULAR WEIGHT: 400.68012
SMILES: CC(C)C(C)CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
Structure:
CAS RN: 35060-03-8
CAS Name: 3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17-carbonitrile
OPENEYE Name: 3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17-carbonitrile
IUPAC Name: 3,17-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17-carbonitrile
SYSTEMATIC NAME: 10,13-dimethyl-3,17-bis(oxidanyl)-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17-carbonitrile
MOLECULAR FORMULA: C20H29NO2
MOLECULAR WEIGHT: 315.44976
SMILES: CC12CCC(CC1=CCC3C2CCC4(C3CCC4(C#N)O)C)O
Structure:
CAS RN: 302-97-6
CAS Name: 10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-17-carboxylic acid
OPENEYE Name: 10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-17-carboxylic acid
IUPAC Name: 10,13-dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-17-carboxylic acid
SYSTEMATIC NAME: 10,13-dimethyl-3-oxidanylidene-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-17-carboxylic acid
MOLECULAR FORMULA: C20H28O3
MOLECULAR WEIGHT: 316.43452
SMILES: CC12CCC3C(C1CCC2C(=O)O)CCC4=CC(=O)CCC34C
Structure:
CAS RN: 5329-54-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C30H40N2O12
MOLECULAR WEIGHT: 620.6448
SMILES: COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC.C(C(C(C(C(C(C(=O)O)O)O)O)O)O)O
Structure:
CAS RN: 79686-91-2
CAS Name: N-(2,5-dioxo-3-oxolanyl)-2,2,2-trifluoroacetamide
OPENEYE Name: N-(2,5-dioxotetrahydrofuran-3-yl)-2,2,2-trifluoro-acetamide
IUPAC Name: N-(2,5-dioxooxolan-3-yl)-2,2,2-trifluoroacetamide
SYSTEMATIC NAME: N-[2,5-bis(oxidanylidene)oxolan-3-yl]-2,2,2-tris(fluoranyl)ethanamide
MOLECULAR FORMULA: C6H4F3NO4
MOLECULAR WEIGHT: 211.09547
SMILES: C1C(C(=O)OC1=O)NC(=O)C(F)(F)F
Structure:
CAS RN: 78259-50-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H22O5
MOLECULAR WEIGHT: 330.37498
SMILES: CC12CC=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O
Structure:
CAS RN: 7706-90-3
CAS Name: 3-(4-hydroxyphenyl)-2H-furan-5-one
OPENEYE Name: 3-(4-hydroxyphenyl)-2H-furan-5-one
IUPAC Name: 3-(4-hydroxyphenyl)-2H-furan-5-one
SYSTEMATIC NAME: 3-(4-hydroxyphenyl)-2H-furan-5-one
MOLECULAR FORMULA: C10H8O3
MOLECULAR WEIGHT: 176.16872
SMILES: C1C(=CC(=O)O1)C2=CC=C(C=C2)O
Structure:
CAS RN: 74628-94-7
CAS Name: benzoic acid [7-(benzoyloxymethyl)-5,6-dihydroxy-1,3-dioxepan-4-yl]methyl ester
OPENEYE Name: [7-(benzoyloxymethyl)-5,6-dihydroxy-1,3-dioxepan-4-yl]methyl benzoate
IUPAC Name: [7-(benzoyloxymethyl)-5,6-dihydroxy-1,3-dioxepan-4-yl]methyl benzoate
SYSTEMATIC NAME: [5,6-bis(oxidanyl)-7-(phenylcarbonyloxymethyl)-1,3-dioxepan-4-yl]methyl benzoate
MOLECULAR FORMULA: C21H22O8
MOLECULAR WEIGHT: 402.39458
SMILES: C1OC(C(C(C(O1)COC(=O)C2=CC=CC=C2)O)O)COC(=O)C3=CC=CC=C3
Structure:
CAS RN: 40330-92-5
CAS Name: 4-methylbenzenesulfonic acid [5,6-dihydroxy-7-[(4-methylphenyl)sulfonyloxymethyl]-1,3-dioxepan-4-yl]methyl ester
OPENEYE Name: [5,6-dihydroxy-7-(p-tolylsulfonyloxymethyl)-1,3-dioxepan-4-yl]methyl 4-methylbenzenesulfonate
IUPAC Name: [5,6-dihydroxy-7-[(4-methylphenyl)sulfonyloxymethyl]-1,3-dioxepan-4-yl]methyl 4-methylbenzenesulfonate
SYSTEMATIC NAME: [7-[(4-methylphenyl)sulfonyloxymethyl]-5,6-bis(oxidanyl)-1,3-dioxepan-4-yl]methyl 4-methylbenzenesulfonate
MOLECULAR FORMULA: C21H26O10S2
MOLECULAR WEIGHT: 502.55514
SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(OCO2)COS(=O)(=O)C3=CC=C(C=C3)C)O)O
Structure:
CAS RN: 632-32-6
CAS Name: 17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
OPENEYE Name: 10,13-dimethyl-17-(1,4,5-trimethylhexyl)-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
IUPAC Name: 17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SYSTEMATIC NAME: 17-(5,6-dimethylheptan-2-yl)-10,13-dimethyl-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
MOLECULAR FORMULA: C28H48O
MOLECULAR WEIGHT: 400.68012
SMILES: CC(C)C(C)CCC(C)C1CCC2=C3CCC4CC(CCC4(C3CCC12C)C)O
Structure:
CAS RN: 4820-56-8
CAS Name: 3-methoxy-13-methyl-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-17-one
OPENEYE Name: 3-methoxy-13-methyl-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-17-one
IUPAC Name: 3-methoxy-13-methyl-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-17-one
SYSTEMATIC NAME: 3-methoxy-13-methyl-12,14,15,16-tetrahydro-11H-cyclopenta[a]phenanthren-17-one
MOLECULAR FORMULA: C19H20O2
MOLECULAR WEIGHT: 280.3609
SMILES: CC12CCC3=C(C1CCC2=O)C=CC4=C3C=CC(=C4)OC
Structure:
CAS RN: 68422-03-7
CAS Name: 10,13-dimethyl-17-[1-(5-methyl-2-piperidinyl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol
OPENEYE Name: 10,13-dimethyl-17-[1-(5-methyl-2-piperidyl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol
IUPAC Name: 10,13-dimethyl-17-[1-(5-methylpiperidin-2-yl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol
SYSTEMATIC NAME: 10,13-dimethyl-17-[1-(5-methylpiperidin-2-yl)ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol
MOLECULAR FORMULA: C27H45NO2
MOLECULAR WEIGHT: 415.6517
SMILES: CC1CCC(NC1)C(C)C2C(CC3C2(CCC4C3CC=C5C4(CCC(C5)O)C)C)O
Structure:
CAS RN: 65391-73-3
CAS Name: acetic acid [6-(3-acetyloxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxoheptyl] ester
OPENEYE Name: [6-(3-acetoxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxo-heptyl] acetate
IUPAC Name: [6-(3-acetyloxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxoheptyl] acetate
SYSTEMATIC NAME: [6-(3-acetyloxy-10,13-dimethyl-16-oxidanylidene-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxidanylidene-heptyl] ethanoate
MOLECULAR FORMULA: C31H46O6
MOLECULAR WEIGHT: 514.69334
SMILES: CC(CCC(=O)C(C)C1C(=O)CC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)COC(=O)C
Structure:
CAS RN: 7554-95-2
CAS Name: acetic acid [6-(3-acetyloxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxoheptyl] ester
OPENEYE Name: [6-(3-acetoxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxo-heptyl] acetate
IUPAC Name: [6-(3-acetyloxy-10,13-dimethyl-16-oxo-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxoheptyl] acetate
SYSTEMATIC NAME: [6-(3-acetyloxy-10,13-dimethyl-16-oxidanylidene-1,2,3,4,7,8,9,11,12,14,15,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-5-oxidanylidene-heptyl] ethanoate
MOLECULAR FORMULA: C31H46O6
MOLECULAR WEIGHT: 514.69334
SMILES: CC(CCC(=O)C(C)C1C(=O)CC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C)COC(=O)C
Structure:
CAS RN: 2278-46-8
CAS Name: 17-[1-[2-(dimethylamino)ethylamino]ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
OPENEYE Name: 17-[1-[2-(dimethylamino)ethylamino]ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
IUPAC Name: 17-[1-[2-(dimethylamino)ethylamino]ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
SYSTEMATIC NAME: 17-[1-[2-(dimethylamino)ethylamino]ethyl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
MOLECULAR FORMULA: C25H46N2O
MOLECULAR WEIGHT: 390.64554
SMILES: CC(C1CCC2C1(CCC3C2CCC4C3(CCC(C4)O)C)C)NCCN(C)C
Structure:
CAS RN: 35474-20-5
CAS Name: N-chloro-1-phenylethanamine
OPENEYE Name: N-chloro-1-phenyl-ethanamine
IUPAC Name: N-chloro-1-phenylethanamine
SYSTEMATIC NAME: N-chloranyl-1-phenyl-ethanamine
MOLECULAR FORMULA: C8H10ClN
MOLECULAR WEIGHT: 155.6247
SMILES: CC(C1=CC=CC=C1)NCl
Structure:
CAS RN: 33617-85-5
CAS Name: N-(2-methyl-1-phenylpropyl)acetamide
OPENEYE Name: N-(2-methyl-1-phenyl-propyl)acetamide
IUPAC Name: N-(2-methyl-1-phenylpropyl)acetamide
SYSTEMATIC NAME: N-(2-methyl-1-phenyl-propyl)ethanamide
MOLECULAR FORMULA: C12H17NO
MOLECULAR WEIGHT: 191.26948
SMILES: CC(C)C(C1=CC=CC=C1)NC(=O)C
Structure:
CAS RN: 55933-64-7
CAS Name: phenyl-[5-phenyl-1-propan-2-yl-4-(propan-2-ylamino)-3-pyrrolyl]methanone
OPENEYE Name: [1-isopropyl-4-(isopropylamino)-5-phenyl-pyrrol-3-yl]-phenyl-methanone
IUPAC Name: phenyl-[5-phenyl-1-propan-2-yl-4-(propan-2-ylamino)pyrrol-3-yl]methanone
SYSTEMATIC NAME: phenyl-[5-phenyl-1-propan-2-yl-4-(propan-2-ylamino)pyrrol-3-yl]methanone
MOLECULAR FORMULA: C23H26N2O
MOLECULAR WEIGHT: 346.46534
SMILES: CC(C)NC1=C(N(C=C1C(=O)C2=CC=CC=C2)C(C)C)C3=CC=CC=C3
Structure:
CAS RN: 24745-01-5
CAS Name: 2-[hydroxy-(3-methoxyphenyl)methyl]butanoic acid ethyl ester
OPENEYE Name: ethyl 2-[hydroxy-(3-methoxyphenyl)methyl]butanoate
IUPAC Name: ethyl 2-[hydroxy-(3-methoxyphenyl)methyl]butanoate
SYSTEMATIC NAME: ethyl 2-[(3-methoxyphenyl)-oxidanyl-methyl]butanoate
MOLECULAR FORMULA: C14H20O4
MOLECULAR WEIGHT: 252.3062
SMILES: CCC(C(C1=CC(=CC=C1)OC)O)C(=O)OCC
Structure:
No comments:
Post a Comment