3alpha,6alpha,7alpha-Trihydroxy-5beta-cholanic Acid
Product Specifications
CAS Number
547-75-1
Synonyms
Cholan-24-oic acid, 3,6,7-trihydroxy-, (3α,5β,6α,7α)-; 5β-Cholan-24-oic acid, 3α,6α,7α-trihydroxy- (8CI); 5β-Cholanic acid, 3α,6α,7α-trihydroxy- (7CI); (3α,5β,6α,7α)-3,6,7-Trihydroxycholan-24-oic acid; 3α,6α,7α-Trihydroxy-5β-cholan-24-oic acid; 3α,6α,7α-T
Hazard Statement
Not a hazardous substance according to GHS.
Smiles
C[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)[C@H](O)[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
Molecular Formula
C24 H40 O5
Molecular Weight
408.571
InChI
InChI=1S/C24H40O5/c1-13(4-7-19(26)27)15-5-6-16-20-17(9-11-23(15,16)2)24(3)10-8-14(25)12-18(24)21(28)22(20)29/h13-18,20-22,25,28-29H,4-12H2,1-3H3,(H,26,27)/t13-,14-,15-,16+,17+,18+,20+,21-,22+,23-,24-/m1/s1
Additionnal Information
IUPAC name: (4R)-4-[(3R,5R,6R,7S,8S,9S,10R,13R,14S,17R)-3,6,7-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
Shipping Conditions
Room Temperature
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