Products 1249-75-8

CAS 1249-75-8 is the registry number for Methyl Lithocholate, >95% (HPLC). Offered by: TRC. Available pack sizes: 10mg, 50mg, 5mg.

Methyl Lithocholate, >95% (HPLC)
TRC
  • size: 10mg, 50mg, 5mg
  • Variants: 3
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Structural formula: {0} (CAS {1})

Methyl (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-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 1249-75-8) is a chemical compound with the molecular formula C25H42O3 and a molecular weight of 390.6 g/mol. IUPAC name: methyl (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-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: YXZVCZUDUJEPPK-ULCLHEGSSA-N.

Identity
Molecular formulaC25H42O3
Molecular weight390.6 g/mol
IUPAC namemethyl (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-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
InChIKeyYXZVCZUDUJEPPK-ULCLHEGSSA-N
SMILESC[C@H](CCC(=O)OC)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C

Computed by PubChem (NCBI)

Synonyms: Methyl lithocholate, Lithocholic acid, methyl ester, Methyl 3alpha-hydroxy-5beta-cholan-24-oate, lithocholic acid methyl ester, Methyl 3.alpha.-hydroxy-5.beta.-cholanoate, Methyl 3.alpha.-hydroxy-5.beta.-cholan-24-oate, Cholan-24-oic acid, methyl ester, (3.alpha.,5.beta.)-, Methyl isolithocholate, Deoxycholic Acid Impurity 91, Methyl 3-hydroxycholan-24-oate #