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Key Documents

Safety Information

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:
Molecular Weight:
378.58
MDL number:
UNSPSC Code:
12352202
PubChem Substance ID:

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

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

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

JAN Code

589292-BULK:
589292-250MG:
589292-VAR:


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