Products 58822-33-6

CAS 58822-33-6 is the registry number for 3α,12α-Diacetoxy-7α-hydroxy-5β-cholan-24-oic acid methyl ester, 98%. Offered by: Chemat. Available pack sizes: 10mg.

3α,12α-Diacetoxy-7α-hydroxy-5β-cholan-24-oic acid methyl ester, 98%
Chemat
  • size: 10mg
  • Variants: 1
from 1317.20
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Structural formula: {0} (CAS {1})

Methyl 4-(3,12-diacetyloxy-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate (CAS 58822-33-6) is a chemical compound with the molecular formula C29H46O7 and a molecular weight of 506.7 g/mol. IUPAC name: methyl 4-(3,12-diacetyloxy-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate. InChIKey: VKAMWGFHTDGLCF-UHFFFAOYSA-N.

Identity
Molecular formulaC29H46O7
Molecular weight506.7 g/mol
IUPAC namemethyl 4-(3,12-diacetyloxy-7-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate
InChIKeyVKAMWGFHTDGLCF-UHFFFAOYSA-N
SMILESCC(CCC(=O)OC)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)OC(=O)C)C)O)OC(=O)C)C

Computed by PubChem (NCBI)

Synonyms: 3|A,12|A-Diacetoxy-7|A-hydroxy-5|A-cholan-24-oic acid methyl ester
Isomers (same molecular formula)
methyl (4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7-diacetyloxy-12-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate C29H46O7
(2S,3R,5R,9R,10R,13R,14S,17S)-17-[(2R,3R,5R)-5-ethyl-2,3-dihydroxy-6-(hydroxymethyl)hept-6-en-2-yl]-2,3,14-trihydroxy-10,13-dimethyl-2,3,4,5,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-6-one C29H46O7