Glycocholic Acid Ethyl Ester

cas: 517904-33-5 — see every product listed under this CAS number, including other names

Glycocholic Acid Ethyl Ester (CAS 517904-33-5) is a chemical reagent available from Chemat. Available pack sizes: on request, 25mg. Offered by: Chemat Brand, Mikromol.

brandChemat Brand
catalog numberRM-G121502
cas517904-33-5
sizeon request
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properties

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Structural formula: {0} (CAS {1})

Ethyl 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetate (CAS 517904-33-5) is a chemical compound with the molecular formula C28H47NO6 and a molecular weight of 493.7 g/mol. IUPAC name: ethyl 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetate. InChIKey: IUMZSPQFQUFAHS-VVHBOOHCSA-N.

Identity
Molecular formulaC28H47NO6
Molecular weight493.7 g/mol
IUPAC nameethyl 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetate
InChIKeyIUMZSPQFQUFAHS-VVHBOOHCSA-N
SMILESCCOC(=O)CNC(=O)CC[C@@H](C)[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)O)C)O)O)C

Computed by PubChem (NCBI)

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