Ursodeoxycholic acid methyl ester-d5

cas: 93701-19-0 — see every product listed under this CAS number, including other names

Ursodeoxycholic acid methyl ester-d5 (CAS 93701-19-0) is a chemical reagent available from Chemat. Available pack sizes: 1 mg, 10 mg. Offered by: MedChemExpress.

brandMedChemExpress
catalog numberHY-132686S-1 mg
cas93701-19-0
size1 mg
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Structural formula: {0} (CAS {1})

Methyl (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3,7-dihydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoate (CAS 93701-19-0) is a chemical compound with the molecular formula C25H42O4 and a molecular weight of 411.6 g/mol. IUPAC name: methyl (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3,7-dihydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoate. InChIKey: GRQROVWZGGDYSW-IMKCYHQTSA-N.

Identity
Molecular formulaC25H42O4
Molecular weight411.6 g/mol
IUPAC namemethyl (4R)-4-[(3R,5S,7S,8R,9S,10S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3,7-dihydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
InChIKeyGRQROVWZGGDYSW-IMKCYHQTSA-N
SMILES[2H][C@]1(C(C[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3[C@H](C[C@@H]2C1([2H])[2H])O)CC[C@@H]4[C@H](C)CCC(=O)OC)C)C)([2H])[2H])O

Computed by PubChem (NCBI)

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