3alpha,7alpha,12alpha-Trihydroxy-5beta-cholan-24-oic Acid (Cholic Acid)
Product Code
MM0835.02-0250
CAS Number
EP Description
Chenodeoxycholic Acid Impurity B, Ursodeoxycholic Acid Impurity B
Product Format
Neat
Matrix
Molecular Formula
C24 H40 O5
Molecular Weight
408.57
Product Categories
Steroids and derivatives, API standards, Impurity standards, Mikromol, Excipient standards
Product Type
Documentation
Certificate of Analysis
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Safety Data Sheet
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Product Information
Analyte Name
Cholic Acid
CAS Number
81-25-4
Molecular Formula
C24 H40 O5
Molecular Weight
408.57
Accurate Mass
408.2876
Smiles
C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
InChI
InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1
IUPAC
(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
Storage Temperature
+5°C
Shipping Temperature
Room Temperature
Country of Origin
GERMANY
Product Type
API; Excipient; Impurity
Product Format
Neat