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Safety Information

900073

Sigma-Aldrich

Sodium taurodeoxycholate-2,2,4,4-d4

≥98 atom % D, ≥98% (CP)

Synonym(s):

Taurodeoxycholic-2,2,4,4-d4 acid sodium salt

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About This Item

Linear Formula:
C26D4H40NO6SNa
Molecular Weight:
525.71
UNSPSC Code:
12352106
PubChem Substance ID:
NACRES:
NA.12

isotopic purity

≥98 atom % D

Quality Level

Assay

≥98% (CP)

form

powder

technique(s)

mass spectrometry (MS): suitable

mass shift

M+4

storage temp.

−20°C

SMILES string

C[C@@]12C(CC[C@H]2[C@H](C)CCC(NCCS(=O)(O[Na])=O)=O)C3CCC4C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)C3C[C@@H]1O

InChI

1S/C26H45NO6S.Na/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3;/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17?,18-,19?,20?,21?,22?,23+,25+,26-;/m1./s1/i10D2,14D2;

InChI key

YXHRQQJFKOHLAP-DAGKUMDOSA-M

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable


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

900073-VAR:
900073-10MG-PW:
900073-10MG:
900073-BULK:


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