(3Alpha,5Beta,6Beta,7Alpha)-3-((Ethoxycarbonyl)oxy)-6-(formyloxy)-7-hydroxycholan-24-oic Acid Methyl Ester

cas: 125112-77-8 — see every product listed under this CAS number, including other names

(3Alpha,5Beta,6Beta,7Alpha)-3-((Ethoxycarbonyl)oxy)-6-(formyloxy)-7-hydroxycholan-24-oic Acid Methyl Ester (CAS 125112-77-8) is a chemical reagent available from Chemat. Available pack sizes: 50mg, 5mg. Offered by: TRC.

brandTRC
catalog numberTRC-E891350-50MG
cas125112-77-8
size50mg
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properties

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delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

Methyl (4R)-4-[(3R,5R,6S,7S,8S,9S,10R,13R,14S,17R)-3-ethoxycarbonyloxy-6-formyloxy-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 125112-77-8) is a chemical compound with the molecular formula C29H46O8 and a molecular weight of 522.7 g/mol. IUPAC name: methyl (4R)-4-[(3R,5R,6S,7S,8S,9S,10R,13R,14S,17R)-3-ethoxycarbonyloxy-6-formyloxy-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: KQNHAMQGLTWKCF-JQVYKAOOSA-N.

Identity
Molecular formulaC29H46O8
Molecular weight522.7 g/mol
IUPAC namemethyl (4R)-4-[(3R,5R,6S,7S,8S,9S,10R,13R,14S,17R)-3-ethoxycarbonyloxy-6-formyloxy-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
InChIKeyKQNHAMQGLTWKCF-JQVYKAOOSA-N
SMILESCCOC(=O)O[C@@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3[C@@H]([C@H]([C@@H]2C1)OC=O)O)CC[C@@H]4[C@H](C)CCC(=O)OC)C)C

Computed by PubChem (NCBI)