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Chemical structure of BAR502

GC30565

BAR502

Also known as (3R,5S,6R,7R,8S,9S,10S,13R,14S,17R)-6-ethyl-17-[(2R)-4-hydroxybutan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

A dual agonist of GP-BAR1 and FXR

ChemicalCAS1612191-86-2MW392.62FormulaC25H44O3
CAS number
1612191-86-2
Molecular weight
392.62
Formula
C25H44O3
Solubility
DMF ： 50 mg/mL (127·35 mM)
InChIKey
HYCMOIGNYNCMRH-APIYUPOTSA-N
Catalogue number
GC30565
Brand
GLPBIO
Computed properties PubChem CID 101886309 · XLogP 5.5 · TPSA 60.7 Ų · H-bond donors 3
XLogP
5.5
TPSA
60.7 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
28

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)CCO)C)C)O

Computed descriptors from PubChem (CID 101886309), 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
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