Tauro-d4-cholic Acid Sodium Salt

CAS: 145-42-6

Ref. TR-S080849

Product Information

• Name: Tauro-d4-cholic Acid Sodium Salt
• Synonyms: 2-[[(3α,5β,7α,12α)-3,7,12-Trihydroxy-24-oxocholan-24-yl]amino]ethane-1,1,2,2-d4-sulfonic acid sodium salt, Taurocholic acid D4 (taurine-D4) sodium salt, Sodium taurocholate-d4 (taurine-d4), Sodium cholanoyl(taurine-1,1,2,2-d4), Sodium N-choloyltaurine-d4, Sodium taurocholate-D4 (taurine-D4), Sodium (tauro-d4)cholate
• Brand: TRC
• Description: Applications Tauro-d4-cholic Acid Sodium Salt is a useful isotopically labeled compound of Sodium Taurocholate (S080848)

Chemical properties

• Molecular weight: 541.71
• Formula: C₂₆D₄H₄₀NO₇S·Na
• Color/Form: Neat
• 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);/q;+1/p-1/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-;/m1./s1/i10D2,11D2
• InChI key: InChIKey=JAJWGJBVLPIOOH-OGYFWEOCSA-M
• SMILES: [2H]C([2H])(NC(=O)CCC(C)C1CCC2C3C(C[C@H](O)C12C)C1(C)CC[C@@H](O)C[C@H]1C[C@H]3O)C([2H])([2H])S(=O)(=O)O[Na]