3Β-Ursodeoxycholic Acid

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Catalog Number ACM78919263
Product Name 3Β-Ursodeoxycholic Acid
CAS Number 78919-26-3
Structure 3Β-Ursodeoxycholic Acid
IUPAC Name (4R)-4-[(3S,5S,7S,8R,9S,10S,13R,14S,17R)-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]pentanoic acid
Synonyms (3β,5β,7β)-3,7-Dihydroxycholan-24-oic Acid; 3β,7β-Dihydroxy-5β-cholan-24-oic Acid; 3β,7β-Dihydroxy-5β-cholanic Acid; 3β,7β-Dihydroxy-5β-cholanoic Acid; Isoursodeoxycholic Acid;
Molecular Weight 392.57
Molecular Formula C24H40O4
Canonical SMILES C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@@H](
InChIKey RUDATBOHQWOJDD-DNMBCGTGSA-N
Boiling Point 547.1±25.0 °C at 760 mmHg (Predicted)
Melting Point 184-186 °C
Flash Point 298.8ºC
Purity 96%
Density 1.1±0.1 g/cm3(Predicted)

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