Nuatigenin
[CAS# 6811-35-4]

Identification

• Name: Nuatigenin
• Synonyms: Nuatigenin; (22S,25S)-22,25-Epoxyfurost-5-Ene-3Beta,26-Diol; Chebi:15574
• Molecular Formula: C₂₇H₄₂O₄
• Molecular Weight: 430.63
• CAS Registry Number: 6811-35-4
• SMILES: [C@]24([C@H]([C@@H]1CC=C3[C@@]([C@H]1CC2)(CC[C@H](O)C3)C)C[C@@H]5O[C@]6([C@H]([C@H]45)C)O[C@@](CO)(C)CC6)C
• InChI: 1S/C27H42O4/c1-16-23-22(30-27(16)12-11-24(2,15-28)31-27)14-21-19-6-5-17-13-18(29)7-9-25(17,3)20(19)8-10-26(21,23)4/h5,16,18-23,28-29H,6-15H2,1-4H3/t16-,18-,19+,20-,21-,22-,23-,24-,25-,26-,27-/m0/s1
• InChIKey: NELZMZLNTYWIPD-MLBSDYKWSA-N

Properties

• Density: 1.183g/cm³ (Cal.)
• Boiling point: 555.923°C at 760 mmHg (Cal.)
• Flash point: 290.012°C (Cal.)