5β-Cholanic acid 3,7-dione methyl ester

cas: 7753-72-2 — see every product listed under this CAS number, including other names

5β-Cholanic acid 3,7-dione methyl ester (CAS 7753-72-2) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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Methyl (4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-dioxo-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate (CAS 7753-72-2) is a chemical compound with the molecular formula C25H38O4 and a molecular weight of 402.6 g/mol. IUPAC name: methyl (4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-dioxo-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate. InChIKey: UZRRNRRCPZZPNY-AEVHJRAPSA-N.

Identity
Molecular formulaC25H38O4
Molecular weight402.6 g/mol
IUPAC namemethyl (4R)-4-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-3,7-dioxo-2,4,5,6,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate
InChIKeyUZRRNRRCPZZPNY-AEVHJRAPSA-N
SMILESC[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CCC(=O)C4)C)C

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