Tauroocholic acid-d4 ( sodium salt)

Product number: 65-1019
CAS number: 2410279-93-3

Identifiers

CAS Index Name: Ethanesulfonic Acid-d4
Molecular formula: C26H41D4NO7S.Na
Molecular weight: 542.72
Smiles: C[C@H](CCC(NCCS([O-])(=O)=O)=O)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C([2H])([2H])[C@H](O)C([2H])([2H])C[C@]4(C)[C@@]3([H])C[C@H](O)[C@@]21C.[Na+]
Isomeric Smiles: O[C@H]1[C@]2([C@]3([C@@](C)([C@@]([C@@H](CCC(NCCS(=O)(=O)O)=O)C)(CC3)[H])[C@@H](O)C[C@@]2([C@]4(C)[C@](C1)(C([C@H](O)C(C4)([2H])[2H])([2H])[2H])[H])[H])[H])[H].[Na]
InChI: InChI=1S/C26H45NO7S.Na/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29;/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34);/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-;/m1./s1/i8D2,12D2;
InChIKey: LHLYEKPSOJJBMK-QPNQQDKZSA-N

Product information

Purity: >99%
Storage: Freezer
Physical state: Solid
Documentation: Certificate of Analysis
MSDS: Ask for MSDS

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65-1019-4Tauroocholic acid-d4 ( sodium salt) - 5 mg