24-Methylcholestane-3,7,12,25-Tetrol
[CAS# 93522-96-4]

Identification

• Name: 24-Methylcholestane-3,7,12,25-Tetrol
• Synonyms: (3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(1R,4R)-5-Hydroxy-1,4,5-Trimethyl-Hexyl]-10,13-Dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-Tetradecahydro-1H-Cyclopenta[A]Phenanthrene-3,7,12-Triol; (3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(1R,4R)-5-Hydroxy-1,4,5-Tr
• Molecular Formula: C₂₈H₅₀O₄
• Molecular Weight: 450.70
• CAS Registry Number: 93522-96-4
• SMILES: [C@H]1(CC[C@]3([C@@H](C1)C[C@H]([C@H]4[C@@H]2CC[C@H]([C@@H](CC[C@H](C(C)(C)O)C)C)[C@@]2(C)[C@H](C[C@H]34)O)O)C)O
• InChI: 1S/C28H50O4/c1-16(7-8-17(2)26(3,4)32)20-9-10-21-25-22(15-24(31)28(20,21)6)27(5)12-11-19(29)13-18(27)14-23(25)30/h16-25,29-32H,7-15H2,1-6H3/t16-,17-,18+,19-,20-,21+,22+,23-,24+,25+,27+,28-/m1/s1
• InChIKey: IHJZJTWPTQVDFK-JZPQJZBMSA-N

Properties

• Density: 1.088g/cm³ (Cal.)
• Boiling point: 575.048°C at 760 mmHg (Cal.)
• Flash point: 238.292°C (Cal.)