Rockogenin
[CAS# 16653-52-4]

Identification

• Name: Rockogenin
• Synonyms: Spirostan-3,12-Diol, (3Beta,5Alpha,12Beta,25R)-
• Molecular Formula: C₂₇H₄₄O₄
• Molecular Weight: 432.64
• CAS Registry Number: 16653-52-4
• SMILES: [C@]24([C@H]([C@@H]1CC[C@@H]3[C@@]([C@H]1C[C@H]2O)(CC[C@H](O)C3)C)C[C@H]6[C@@H]4[C@@H]([C@]5(OC[C@@H](CC5)C)O6)C)C
• InChI: 1S/C27H44O4/c1-15-7-10-27(30-14-15)16(2)24-22(31-27)12-21-19-6-5-17-11-18(28)8-9-25(17,3)20(19)13-23(29)26(21,24)4/h15-24,28-29H,5-14H2,1-4H3/t15-,16+,17+,18+,19-,20+,21+,22+,23-,24+,25+,26-,27-/m1/s1
• InChIKey: BQNMOLSYHYSCMS-TUUYSWIFSA-N

Properties

• Density: 1.162g/cm³ (Cal.)
• Boiling point: 550.452°C at 760 mmHg (Cal.)
• Flash point: 286.703°C (Cal.)