Products 246529-32-8

CAS 246529-32-8 is the registry number for Methyl (3beta,5beta,7alpha,12alpha)-7,12-Dihydroxy-3-((1-oxoeicosyl)amino)-cholan-24-oic Acid Ester. Offered by: TRC. Available pack sizes: 2,5g.

Methyl (3beta,5beta,7alpha,12alpha)-7,12-Dihydroxy-3-((1-oxoeicosyl)amino)-cholan-24-oic Acid Ester
TRC
  • size: 2,5g
  • Variants: 1
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Structural formula: {0} (CAS {1})

Methyl (4R)-4-[(3S,10S,12S,13R,17R)-7,12-dihydroxy-3-(icosanoylamino)-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 246529-32-8) is a chemical compound with the molecular formula C45H81NO5 and a molecular weight of 716.1 g/mol. IUPAC name: methyl (4R)-4-[(3S,10S,12S,13R,17R)-7,12-dihydroxy-3-(icosanoylamino)-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: SVERPKDUXIOIQR-ZLFUWPSUSA-N.

Identity
Molecular formulaC45H81NO5
Molecular weight716.1 g/mol
IUPAC namemethyl (4R)-4-[(3S,10S,12S,13R,17R)-7,12-dihydroxy-3-(icosanoylamino)-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
InChIKeySVERPKDUXIOIQR-ZLFUWPSUSA-N
SMILESCCCCCCCCCCCCCCCCCCCC(=O)N[C@H]1CC[C@]2(C(C1)CC(C3C2C[C@@H]([C@]4(C3CC[C@@H]4[C@H](C)CCC(=O)OC)C)O)O)C

Computed by PubChem (NCBI)

Synonyms: Methyl (14xi)-7,12alpha-dihydroxy-3beta-icosanamido-8xi,9xi-cholan-24-oate