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Product Overview

Product Code

TRC-C291935

CAS Number

2646-38-0

Product Format

Neat

Molecular Formula

C24 H39 O4 . Na

Molecular Weight

414.554

Product Categories

TRC

Product Type

Bioactive Small Molecule

Alternate CAS Number

Free Base: 474-25-9

Documentation

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Product Information

Chemical Data

Analyte Name

Chenodeoxycholic Acid Sodium Salt

CAS Number

2646-38-0

Molecular Formula

C24 H39 O4 . Na

Molecular Weight

414.554

Accurate Mass

414.275

SMILES

[Na+].C[C@H](CCC(=O)[O-])[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]3CC[C@]12C

InChI

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

IUPAC

sodium;(4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-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]pentanoate

Alternate CAS Number

Free Base: 474-25-9

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Chenodeoxycholic Acid Sodium Salt

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