900073
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
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
Related Categories
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
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