Analyte Name

5alpha-Cholanic Acid-3beta-ol-23,23-d2

Molecular Formula

C24H38D2O3

Molecular Weight

378.58

SMILES

O[C@H]1CC[C@]2([C@]([H])(C1)CC[C@]3([H])[C@]2([H])CC[C@]4([C@@]3([H])CC[C@]4([H])[C@H](C)CC([2H])(C(O)=O)[2H])C)C

InChI

InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16+,17+,18+,19-,20+,21+,23+,24-/m1/s1/i9D2

IUPAC

(4R)-2,2-dideuterio-4-[(3S,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-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

Alternate CAS Number

2276-93-9

Unlabelled CAS Number

2276-93-9

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat