Solanid-5-Ene-3beta,18-Diol
[CAS# 468-45-1]

Identification

• Name: Solanid-5-Ene-3beta,18-Diol
• Synonyms: Nsc226131; Solanid-5-Ene-3,18-Diol, (3.Beta.)-; Solanid-5-Ene-3.Beta.,18-Diol
• Molecular Formula: C₂₇H₄₃NO₂
• Molecular Weight: 413.64
• CAS Registry Number: 468-45-1
• SMILES: C(C36C2C(N1CC(C)CCC1C2C)CC3C4C(C5(C(=CC4)CC(O)CC5)C)CC6)O
• InChI: 1S/C27H43NO2/c1-16-4-7-23-17(2)25-24(28(23)14-16)13-22-20-6-5-18-12-19(30)8-10-26(18,3)21(20)9-11-27(22,25)15-29/h5,16-17,19-25,29-30H,4,6-15H2,1-3H3
• InChIKey: NMFWDNZLNHRNAT-UHFFFAOYSA-N

Properties

• Density: 1.153g/cm³ (Cal.)
• Boiling point: 541.928°C at 760 mmHg (Cal.)
• Flash point: 255.931°C (Cal.)