Diosgenin
[CAS# 57701-28-7]

Identification

• Name: Diosgenin
• Molecular Formula: C₂₇H₄₂O₄
• Molecular Weight: 430.63
• CAS Registry Number: 57701-28-7
• SMILES: [C@]36([C@@H]2[C@@H](OC1(OCC(CC1)C)[C@H]2C)CC3(O)[C@H]4[C@@H]([C@@]5(C(=CC4)C[C@@H](O)CC5)C)CC6)C
• InChI: 1S/C27H42O4/c1-16-7-12-27(30-15-16)17(2)23-22(31-27)14-26(29)21-6-5-18-13-19(28)8-10-24(18,3)20(21)9-11-25(23,26)4/h5,16-17,19-23,28-29H,6-15H2,1-4H3/t16?,17-,19-,20-,21+,22-,23-,24-,25+,26?,27?/m0/s1
• InChIKey: WWHAXDOZLPIUEY-MPXKMJENSA-N

Properties

• Density: 1.183g/cm³ (Cal.)
• Boiling point: 561.057°C at 760 mmHg (Cal.)
• Flash point: 293.117°C (Cal.)