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614033

Sigma-Aldrich

Lithocholic acid-2,2,3,4,4-d5

98 atom % D

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About This Item

Empirical Formula (Hill Notation):
C24D5H35O3
Molecular Weight:
381.60
MDL number:
MFCD01075455
UNSPSC Code:
12352106
PubChem Substance ID:
24882135
NACRES:
NA.12

isotopic purity

98 atom % D

Quality Level

200

form

solid

mp

184-186 °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]3CC[C@@H]2C([2H])([2H])[C@]1([2H])O)[C@H](C)CCC(O)=O

InChI

1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17-,18+,19-,20+,21+,23+,24-/m1/s1/i10D2,14D2,17D

InChI key

SMEROWZSTRWXGI-WODFLMNXSA-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

11 - Combustible Solids

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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Sigma-Aldrich

C1129

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