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Chemical structure of Tauro-α-muricholic Acid (sodium salt)

GC44999

Tauro-α-muricholic Acid (sodium salt)

Also known as sodium 2-[[(4R)-4-[(3R,5R,6S,7S,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]ethanesulfonate

Tauro-α-muricholic acid (TαMCA) is an antagonist of the farnesoid X receptor (FXR; IC50 = 28 μM) and a taurine-conjugated form of the murine-specific primary bile acid α-muricholic acid

ChemicalCAS2260905-08-4MW537.7FormulaC26H44NO7S•Na
CAS number
2260905-08-4
Molecular weight
537.7
Formula
C26H44NO7S•Na
Solubility
DMF： 10 mg/mL,DMSO： 10 mg/mL,DMSO：PBS(pH 7·2) (1：4)： 0·2 mg/mL,Ethanol： 1 mg/mL
InChIKey
NYXROOLWUZIWRB-BAMGEBLESA-M
Catalogue number
GC44999
Brand
GLPBIO
Computed properties PubChem CID 137700104 · TPSA 155 Ų · H-bond donors 4 · H-bond acceptors 7
TPSA
155 Ų
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
36

SMILES C[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@@H]([C@H]([C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C.[Na+]

Computed descriptors from PubChem (CID 137700104), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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