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Tauro-beta-muricholic Acid Sodium Salt, TRC

Product Code. 30427528
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Product Code. 30427528 Supplier Toronto Research Chemicals Supplier No. TRCT0091350.5MG

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Description

High-purity organic molecules and analytical standards, strategically delivered worldwide to empower innovation and commercial success.

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Specifications

Chemical Name or Material Tauro-beta-muricholic Acid
CAS 25696-60-0
Purity Grade Notes HPLC
Molecular Formula C26H45NO7S
Quantity 0.5 mg
Synonym 2-[[(3α,5β,6β,7β)-3,6,7-Trihydroxy-24-oxocholan-24-yl]amino]-ethanesulfonic Acid, N-(3α,6β,7β-Trihydroxy-5β-cholan-24-oyl)-taurine, Tauro-β-muricholate
InChI Formula InChI=1S/C26H45NO7S/c1-15(4-7-21(29)27-12-13-35(32,33)34)17-5-6-18-22-19(9-11-25(17,18)2)26(3)10-8-16(28)14-20(26)23(30)24(22)31/h15-20,22-24,28,30-31H,4-14H2,1-3H3,(H,27,29)(H,32,33,34)/t15-,16-,17-,18+,19+,20+,22+,23+,24-,25-,26-/m1/s1
SMILES CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(CCC3C2C(C(C4C3(CCC(C4)O)C)O)O)C
IUPAC Name 2-[[(4R)-4-[(3R,5R,6S,7R,8S,9S,10R,13R,14S,17R)-3,6,7-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid
Molecular Weight (g/mol) 515.7
Formula Weight 515.292
Percent Purity >95
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