Structural formula of Chenodeoxycholic acid

Chenodeoxycholic acid

Product number: 65-1005
CAS number: 474-25-9
Synonyms: Anthropodesoxycholic acid, Chenic acid, Anthropododesoxycholic acid, 17β-(1-Methyl-3-carboxypropyl)etiocholane-3α,7α-diol, (3α,5β,7α)-3,7-Dihydroxycholan-24-oic acid, 5β-Cholanic acid, 3α,7α-dihydroxy-, Chenodeoxycholic acid, 3α,7α-Dihydroxy-5β-cholan-24-oic acid, 3α,7α-Dihydroxy-5β-cholanoic acid, 3α,7α-Dihydroxycholanic acid, 3α,7α-Dihydroxy-5β-cholanic acid, 5β-Cholan-24-oic acid, 3α,7α-dihydroxy-, (+)-Chenodeoxycholic acid, 7α-Hydroxylithocholic acid, Anthropodeoxycholic acid, Gallodesoxycholic acid

Identifiers

CAS Index Name: Cholan-24-oic acid, 3,7-dihydroxy-, (3α,5β,7α)-
Molecular formula: C24H40O4
Molecular weight: 392.57
Smiles: O=C(O)CCC(C)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CCC12C
Isomeric Smiles: CC12C(C3(C(C4(C)C(CC3O)(CC(O)CC4)[H])(CC1)[H])[H])(CCC2(C(CCC(O)=O)C)[H])[H]
InChI: InChI=1S/C24H40O4/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/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
InChIKey: InChIKey=RUDATBOHQWOJDD-BSWAIDMHSA-N

Product information

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

Shop now

65-1005-13Chenodeoxycholic acid - 1 g212.00
65-1005-9Chenodeoxycholic acid - 100 mg79.00