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Product Overview

Product Code

TRC-G679550

CAS Number

64480-66-6

Product Format

Neat

Molecular Formula

C26 H43 N O5

Molecular Weight

449.62

API Family

Ursodeoxycholic Acid

Product Categories

TRC, Lipids

Product Type

Bioactive Small Molecule

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Product Information

Chemical Data

Analyte Name

Glycoursodeoxycholic Acid

CAS Number

64480-66-6

Molecular Formula

C26 H43 N O5

Molecular Weight

449.62

Accurate Mass

449.3141

SMILES

C[C@H](CCC(=O)NCC(=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/C26H43NO5/c1-15(4-7-22(30)27-14-23(31)32)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(28)12-16(25)13-21(24)29/h15-21,24,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/t15-,16+,17-,18-,19+,20+,21+,24+,25+,26-/m1/s1

IUPAC

2-[[(4R)-4-[(3R,5S,7S,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]pentanoyl]amino]acetic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

API Family

Ursodeoxycholic Acid

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