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589292

Sigma-Aldrich

Lithocholic acid-11,12-d2

97 atom % D

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About This Item

Empirical Formula (Hill Notation):
C24D2H38O3
CAS Number:
60051-93-6
Molecular Weight:
378.58
MDL number:
MFCD00190472
UNSPSC Code:
12352202
PubChem Substance ID:
24881073

isotopic purity

97 atom % D

mp

184-186 °C (lit.)

mass shift

M+2

SMILES string

[H][C@]12CC[C@@]3([H])[C@]4([H])CC[C@H]([C@H](C)CCC(O)=O)[C@@]4(C)C([2H])C([2H])[C@]3([H])[C@@]1(C)CC[C@@H](O)C2

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/i11D,13D/t11?,13?,15-,16-,17-,18+,19-,20+,21+,23+,24-

InChI key

SMEROWZSTRWXGI-YBRLEOEUSA-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.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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