Name: 3Beta-Cholic Acid-d5
Brand: TRC
SKU: TRC-C432607

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Product Overview

Product Code

TRC-C432607

Product Format

Neat

Molecular Formula

C24H35D5O5

Molecular Weight

413.6

Product Categories

TRC, Stable isotopes

Product Type

Stable Isotope Labelled

Unlabelled CAS Number

3338-16-7

Documentation

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Product Information

Analyte Name

3beta-Cholic Acid-d5

Molecular Formula

C24H35D5O5

Molecular Weight

413.6

Accurate Mass

413.32

SMILES

O[C@@H]1([2H])C([2H])([2H])C[C@@]2(C)[C@@](C[C@@H2]([OH])C3C2C[C@H2]([OH])[C@@]4(C)[C@@H]3([H])CC[C@@H]4[C@@H2](CCC(O)=O)C)([H])C1([2H])[2H]

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/i8D2,10D2,15D

IUPAC

(4R)-4-((3S,5S,7R,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl-2,2,3,4,4-d5)pentanoic acid

Unlabelled CAS Number

3338-16-7

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat

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