Magnesium Bis[(3alpha,5beta,12alpha)-3,12-Dihydroxycholan-24-Oate]
[CAS# 71888-65-8]

Identification

• Name: Magnesium Bis[(3alpha,5beta,12alpha)-3,12-Dihydroxycholan-24-Oate]
• Synonyms: 4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-3,12-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]Valeric Acid; 17-Beta-(1-Methyl-3-Carboxypropyl)-Etiocholane-3-Alpha,12-Alpha-Diol; 3,12-Dihydroxycholan-24-Oic Acid, (3Alpha,5Beta,12Alpha)-
• Molecular Formula: C₂₄H₄₀O₄
• Molecular Weight: 392.58
• CAS Registry Number: 71888-65-8
• EINECS: 276-152-9
• SMILES: [C@@H]3(O)[C@]4([C@H]([C@H]2[C@@H]([C@@]1([C@@H](C[C@@H](CC1)O)CC2)C)C3)CC[C@@H]4C(CCC(=O)O)C)C
• InChI: 1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14?,15-,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1
• InChIKey: KXGVEGMKQFWNSR-DVASNTQSSA-N

Properties

• Density: 1.129g/cm³ (Cal.)
• Boiling point: 547.148°C at 760 mmHg (Cal.)
• Flash point: 298.768°C (Cal.)