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739715

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
UNSPSC Code:
12352106
PubChem Substance ID:
329765375
MDL number:
MFCD03425572
Isotopic purity:
98 atom % D
Assay:
98% (CP)
Mass shift:
M+4
Form:
liquid

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

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

10 - Combustible liquids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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Certificates of Analysis (COA)

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