Products 52840-06-9

CAS 52840-06-9 appears in our catalog under these names: Lithocholic-2,2,3,4,4-d5 Acid, Lithocholic acid-d5. Offered by: Chemat Brand, MedChemExpress. Available pack sizes: on request, 1 mg, 10 mg, 5 mg.

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

(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3-hydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid (CAS 52840-06-9) is a chemical compound with the molecular formula C24H40O3 and a molecular weight of 381.6 g/mol. IUPAC name: (4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3-hydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid. InChIKey: SMEROWZSTRWXGI-WODFLMNXSA-N.

Identity
Molecular formulaC24H40O3
Molecular weight381.6 g/mol
IUPAC name(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3-hydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
InChIKeySMEROWZSTRWXGI-WODFLMNXSA-N
SMILES[2H][C@]1(C(C[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC[C@@H]2C1([2H])[2H])CC[C@@H]4[C@H](C)CCC(=O)O)C)C)([2H])[2H])O

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