Products 4651-67-6

CAS 4651-67-6 appears in our catalog under these names: Chenodeoxycholic Acid Impurity 6, Nutriacholic acid, 98%, Ursodeoxycholic Acid EP Impurity F, Ursodeoxycholic Acid Impurity 6(Ursodeoxycholic Acid EP Impurity F), Nutriacholic Acid. Offered by: Hubei YoungXin, Combi-blocks, Chemat Brand, TRC, GLPBio. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg, 25g, 5g, 1g.

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

7-oxolithocholic acid is a bile acid that is lithocholic acid carrying an additional oxo substituent at position 7. It has a role as a human metabolite. It is an oxo-5beta-cholanic acid, a bile acid, a monohydroxy-5beta-cholanic acid and a 3alpha-hydroxy steroid. It is functionally related to a lithocholic acid. It is a conjugate acid of a 7-oxolithocholate.

Source: ChEBI

Identity
Molecular formulaC24H38O4
Molecular weight390.6 g/mol
IUPAC name(4R)-4-[(3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7-oxo-1,2,3,4,5,6,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
InChIKeyDXOCDBGWDZAYRQ-AURDAFMXSA-N
SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C(=O)C[C@H]4[C@@]3(CC[C@H](C4)O)C)C

Computed by PubChem (NCBI)