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Chemical structure of Tauro-Obeticholic Acid (sodium salt)

GC91042

Tauro-Obeticholic Acid (sodium salt)

Also known as sodium 2-[[(4R)-4-[(3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-3,7-dihydroxy-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

An active metabolite of obeticholic acid

ChemicalCAS2278141-79-8MW549.7FormulaC28H48NO6S • Na
CAS number
2278141-79-8
Molecular weight
549.7
Formula
C28H48NO6S • Na
Solubility
DMF: 20 mg/ml,DMSO: 20 mg/ml,Ethanol: 20 mg/ml,PBS (pH 7·2): 2 mg/ml
InChIKey
FYNWRGZEJLGRGW-YIKLTSIESA-M
Catalogue number
GC91042
Brand
GLPBIO
Computed properties PubChem CID 139024277 · TPSA 135 Ų · H-bond donors 3 · H-bond acceptors 6
TPSA
135 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
37

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

Computed descriptors from PubChem (CID 139024277), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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Universities, hospitals and biotech companies across Israel. Research use only — not for diagnostic or therapeutic use.