CAS 47676-48-2 Cholic Acid Ethyl Ester - Analytical Products / Alfa Chemistry

CAT	APS47676482
CAS	47676-48-2
Structure
Synonyms	Cholan-24-oic acid, 3,7,12-trihydroxy-, ethyl ester, (3α,5β,7α,12α)-, Cholic Acid Ethyl Ester, Ethyl cholate, Cholic acid, ethyl ester (6CI)
IUPAC Name	ethyl (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]pentanoate
Molecular Weight	436.62
Molecular Formula	C26H44O5
Canonical SMILES	CCOC(=O)CC[C@@H](C)[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/C26H44O5/c1-5-31-23(30)9-6-15(2)18-7-8-19-24-20(14-22(29)26(18,19)4)25(3)11-10-17(27)12-16(25)13-21(24)28/h15-22,24,27-29H,5-14H2,1-4H3/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1

Accurate Mass	436.3189
API Family	Matrix - API Family Cholic Acid
Format	Neat
Product Type	Impurity
Shipping	Room Temperature
Size	25MG
Storage Conditions	+5°C
Subcategory	Steroids and derivatives, Mikromol, Impurity standards