alpha-Hyodeoxycholic Acid

Product Specifications

CAS Number

83-49-8

Synonyms

(3alpha,5beta,6alpha)-3,6-Dihydroxycholan-24-oic Acid; 3alpha,6alpha-Dihydroxy-5beta-cholan-24-oate; 3alpha,6alpha-Dihydroxy-5beta-cholan-24-oic Acid; 6alpha-Hydroxylithocholic Acid; 7-Deoxyhyocholic Acid; Hyodeoxycholic Acid; Hyodesoxycholic Acid; Iodeoxycholic Acid; NSC 60672;

Hazard Statement

Not a hazardous substance according to GHS.

Purity

>95% (HPLC)

Smiles

[H][C@@]12C[C@H](O)[C@]3([H])C[C@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]4(C)[C@@]2([H])CC[C@]4([H])[C@H](C)CCC(O)=O

Molecular Formula

C24 H40 O4

Molecular Weight

392.57

InChI

InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-/m1/s1

Additionnal Information

IUPAC name: (4R)-4-[(3R,5R,6S,8S,9S,10R,13R,14S,17R)-3,6-dihydroxy-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