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739715

Sigma-Aldrich

Glycochenodeoxycholic-2,2,4,4-d4 acid

98 atom % D, 98% (CP)

Synonym(s):

3α,7α-Dihydroxy-5β-cholanoic-2,2,4,4-d4 acid N-(carboxymethyl)amide, N-(3α,7α-Dihydroxy-24-oxocholan-24-yl)glycine-2,2,4,4-d4, Chenodeoxycholylglycine-2,2,4,4-d4, Chenodeoxyglycocholic-2,2,4,4-d4 acid

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About This Item

Empirical Formula (Hill Notation):
C26D4H39NO5
CAS Number:
1201918-16-2
Molecular Weight:
453.65
MDL number:
MFCD03425572
UNSPSC Code:
12352106
PubChem Substance ID:
329765375

isotopic purity

98 atom % D

Assay

98% (CP)

form

liquid

mass shift

M+4

SMILES string

[H][C@@]12[C@]([C@](CC([C@H]3O)([2H])[2H])(C)[C@@](C[C@H]2O)([H])C3([2H])[2H])([H])CC[C@@]4(C)[C@@]1([H])CC[C@]4([H])[C@]([H])(C)CCC(NCC(O)=O)=O

InChI

1S/C25H41NO6/c1-24-9-7-15(27)11-14(24)12-20(29)23-17-4-3-16(25(17,2)10-8-18(23)24)19(28)5-6-21(30)26-13-22(31)32/h14-20,23,27-29H,3-13H2,1-2H3,(H,26,30)(H,31,32)/t14-,15+,16+,17-,18-,19+,20+,23-,24-,25+/m0/s1/i7D2,11D2

InChI key

XILGPPBPXPUXQG-LXAYGWTLSA-N

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Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Le Zhan et al.
American journal of physiology. Gastrointestinal and liver physiology, 310(2), G93-G102 (2015-11-14)
Long-term parenteral nutrition (PN) administration can lead to PN-associated liver diseases (PNALD). Although multiple risk factors have been identified for PNALD, to date, the roles of bile acids (BAs) and the pathways involved in BA homeostasis in the development and
Diana M Shih et al.
Journal of lipid research, 56(1), 22-37 (2014-11-08)
We performed silencing and overexpression studies of flavin containing monooxygenase (FMO) 3 in hyperlipidemic mouse models to examine its effects on trimethylamine N-oxide (TMAO) levels and atherosclerosis. Knockdown of hepatic FMO3 in LDL receptor knockout mice using an antisense oligonucleotide

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