(3alpha,5alpha,7alpha,12alpha)-Cholestane-3,7,12,25-Tetrol
[CAS# 60257-29-6]

Identification

• Name: (3alpha,5alpha,7alpha,12alpha)-Cholestane-3,7,12,25-Tetrol
• Synonyms: 5a-Cholestane-3a,7a,12a,25-tetrol; LMST04030031
• Molecular Formula: C₂₇H₄₈O₄
• Molecular Weight: 436.67
• CAS Registry Number: 60257-29-6
• SMILES: O[C@H]4C[C@H]3[C@]([C@@H]2[C@H]([C@@H]1CC[C@H]([C@H](C)CCCC(O)(C)C)[C@@]1(C)[C@@H](O)C2)[C@H](O)C3)(C)CC4
• InChI: 1S/C27H48O4/c1-16(7-6-11-25(2,3)31)19-8-9-20-24-21(15-23(30)27(19,20)5)26(4)12-10-18(28)13-17(26)14-22(24)29/h16-24,28-31H,6-15H2,1-5H3/t16-,17-,18-,19-,20+,21+,22-,23+,24+,26+,27-/m1/s1
• InChIKey: NTIXPPFPXLYJCT-SWXWTCIYSA-N

Properties

• Density: 1.099g/cm³ (Cal.)
• Boiling point: 568.418°C at 760 mmHg (Cal.)
• Flash point: 238.281°C (Cal.)