Cholestane-3,7,26-Triol
[CAS# 15313-69-6]

Identification

• Name: Cholestane-3,7,26-Triol
• Synonyms: (3R,5S,7R,8R,9S,10S,13R,14S,17R)-17-[(1R)-6-Hydroxy-1,5-Dimethyl-Hexyl]-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; (3R,5S,7R,8R,9S,10S,13R,14S,17R)-17-[(1R)-6-Hydroxy-1,5-Dimethylhexyl]-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; (3R,5S,7R,8R,9S,10S,13R,14S,17R)-17-[(2R)-7-Hydroxy-6-Methyl-Heptan-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
• Molecular Formula: C₂₇H₄₈O₃
• Molecular Weight: 420.67
• CAS Registry Number: 15313-69-6
• SMILES: [C@@H]4([C@@H](CCCC(CO)C)C)[C@@]3([C@H]([C@@H]2[C@@H](C[C@@H]1C[C@@H](CC[C@@]1([C@H]2CC3)C)O)O)CC4)C
• InChI: 1S/C27H48O3/c1-17(16-28)6-5-7-18(2)21-8-9-22-25-23(11-13-27(21,22)4)26(3)12-10-20(29)14-19(26)15-24(25)30/h17-25,28-30H,5-16H2,1-4H3/t17?,18-,19+,20-,21-,22+,23+,24-,25+,26+,27-/m1/s1
• InChIKey: OQIJRBFRXGIHMI-UGMUFZQESA-N

Properties

• Density: 1.05g/cm³ (Cal.)
• Boiling point: 539.808°C at 760 mmHg (Cal.)
• Flash point: 225.026°C (Cal.)