Products 28192-77-0

CAS 28192-77-0 is the registry number for Methyl 3-p-Toluenesulfonate-cholic Acid Ester. Offered by: TRC. Available pack sizes: 5g.

Methyl 3-p-Toluenesulfonate-cholic Acid Ester
TRC
  • size: 5g
  • Variants: 1
View product
Structural formula: {0} (CAS {1})

Methyl (4R)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-(4-methylphenyl)sulfonyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate (CAS 28192-77-0) is a chemical compound with the molecular formula C32H48O7S and a molecular weight of 576.8 g/mol. IUPAC name: methyl (4R)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-(4-methylphenyl)sulfonyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate. InChIKey: JSFIZXNNGPOFTB-PDVGBUMXSA-N.

Identity
Molecular formulaC32H48O7S
Molecular weight576.8 g/mol
IUPAC namemethyl (4R)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-dihydroxy-10,13-dimethyl-3-(4-methylphenyl)sulfonyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
InChIKeyJSFIZXNNGPOFTB-PDVGBUMXSA-N
SMILESCC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2CC[C@]3([C@@H](C2)C[C@H]([C@@H]4[C@@H]3C[C@@H]([C@]5([C@H]4CC[C@@H]5[C@H](C)CCC(=O)OC)C)O)O)C

Computed by PubChem (NCBI)

Synonyms: Methyl 3-p-Toluenesulfonate-cholic Acid Ester, JSFIZXNNGPOFTB-PDVGBUMXSA-N