Structural formula of 7-Oxolithocholic Acid

7-Oxolithocholic Acid

Product number: 65-1107
CAS number: 4651-67-6
Synonyms: 5β-Cholan-24-oic acid, 3α-hydroxy-7-oxo-, 7K-LCA, 7-Oxolithocholic acid, 3α-Hydroxy-7-oxo-5β-cholic acid, 7-keto-Lithocholic acid, 7-Oxo-3α-hydroxycholan-24-oic acid, 3α-Hydroxy-7-keto-5β-cholanic acid, (3α,5β)-3-Hydroxy-7-oxocholan-24-oic acid, 5β-Cholanic acid, 3α-hydroxy-7-oxo-, 7-Ketochenodeoxycholic acid, 7-Ketolithocholic acid, NSC 226118, 3α-Hydroxy-7-keto-5β-cholan-24-oic acid, keto-Lithocholic acid, 3α-Hydroxy-7-oxo-5β-cholanoic acid, Nutriacholic acid, 3α-Hydroxy-7-oxo-5β-cholan-24-oic acid, 5β-Cholanic acid-3α-ol-7-one, 3α-Hydroxy-7-oxo-5β-cholanic acid

Identifiers

CAS Index Name: Cholan-24-oic acid, 3-hydroxy-7-oxo-, (3α,5β)-
Molecular formula: C24H38O4
Molecular weight: 390.56
Smiles: O=C(O)CCC(C)C1CCC2C3C(=O)CC4CC(O)CCC4(C)C3CCC12C
Isomeric Smiles: CC12C(C3(C(C4(C)C(CC3=O)(CC(O)CC4)[H])(CC1)[H])[H])(CCC2(C(CCC(O)=O)C)[H])[H]
InChI: InChI=1S/C24H38O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-19,22,25H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,22+,23+,24-/m1/s1
InChIKey: InChIKey=DXOCDBGWDZAYRQ-AURDAFMXSA-N

Product information

Purity: >98%
Storage: Freezer
Supplied as: Neat
Physical state: Solid
Documentation: Certificate of Analysis
MSDS: Download

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65-1107-57-Oxolithocholic Acid - 10 mg56.00 €