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3Beta-Glycocholic Acid, TRC

Product Code. 30393334
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Product Code. 30393334 Supplier Toronto Research Chemicals Supplier No. TRCG641355100MG

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

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Chemical Identifiers

CAS 107589-98-0
Molecular Formula C26H43NO6
Molecular Weight (g/mol) 465.62
Synonym N-[(3β,5β,7α,12α)-3,7,12-Trihydroxy-24-oxocholan-24-yl]glycine, 3β-N-Choloylglycine, 3β-Glycoreductodehydrocholic Acid, 3β,7α,12α-Trihydroxy-5β-cholanic αcid-24-glycine, 3β-Cholylglycine, 3β-Glycine Cholate
IUPAC Name 2-[[(4R)-4-[(3S,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-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]acetic acid
SMILES O[C@@H]1C[C@]2([H])C[C@@H](O)CC[C@]2(C)[C@]3([H])[C@]1([H])[C@@]4([H])[C@]([C@@H]([C@H](C)CCC(NCC(O)=O)=O)CC4)(C)[C@@H](O)C3

Specifications

Quantity 100 mg
InChI Formula InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16+,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1
Formula Weight 465.309
Chemical Name or Material 3beta-Glycocholic Acid
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