Products 96736-29-7

CAS 96736-29-7 is the registry number for (3alpha,5beta,7alpha,12alpha)-Cholane-3,7,12,24-tetrol 3,7,12-Triformate. Offered by: TRC. Available pack sizes: 500mg.

(3alpha,5beta,7alpha,12alpha)-Cholane-3,7,12,24-tetrol 3,7,12-Triformate
TRC
  • size: 500mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-diformyloxy-17-[(2R)-5-hydroxypentan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] formate (CAS 96736-29-7) is a chemical compound with the molecular formula C27H42O7 and a molecular weight of 478.6 g/mol. IUPAC name: [(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-diformyloxy-17-[(2R)-5-hydroxypentan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] formate. InChIKey: UIEBFQHIAGFERQ-XJZYBRFWSA-N.

Identity
Molecular formulaC27H42O7
Molecular weight478.6 g/mol
IUPAC name[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-7,12-diformyloxy-17-[(2R)-5-hydroxypentan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl] formate
InChIKeyUIEBFQHIAGFERQ-XJZYBRFWSA-N
SMILESC[C@H](CCCO)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)OC=O)C)OC=O)OC=O)C

Computed by PubChem (NCBI)

Synonyms: (3?,5?,7?,12?)-Cholane-3,7,12,24-tetrol 3,7,12-Triformate
Isomers (same molecular formula)
(3aR,5aR,6S,9S,10aR)-9-ethoxy-3a,5a-dimethyl-1-propan-2-yl-6-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-2,3,4,5,6,9,10,10a-octahydrocyclohepta[e]indene-8-carbaldehyde C27H42O7