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617024

Sigma-Aldrich

Chenodeoxycholic-2,2,3,4,4-d5 acid

98 atom % D

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About This Item

Empirical Formula (Hill Notation):
C24D5H35O4
Molecular Weight:
397.60
MDL number:
MFCD08702893
UNSPSC Code:
51113400
PubChem Substance ID:
329759651

isotopic purity

98 atom % D

form

solid

technique(s)

mass spectrometry (MS): suitable

mp

165-167 °C (lit.)

mass shift

M+5

SMILES string

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

InChI

1S/C24H40O4/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)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1/i8D2,12D2,16D

InChI key

RUDATBOHQWOJDD-FVAYXOGXSA-N

Related Categories

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.

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H315,H319

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2

Storage Class

11 - Combustible Solids

wgk_germany

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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