Aspidospermatine
[CAS# 5794-14-9]

Identification

• Name: Aspidospermatine
• Synonyms: Aspidospermatine
• Molecular Formula: C₂₁H₂₆N₂O₂
• Molecular Weight: 338.45
• CAS Registry Number: 5794-14-9
• SMILES: [C@]135[C@H](N(C(=O)C)C2=C(OC)C=CC=C12)C[C@@H]4C(\[C@H]3N(CC4)CC5)=C/C
• InChI: 1S/C21H26N2O2/c1-4-15-14-8-10-22-11-9-21(20(15)22)16-6-5-7-17(25-3)19(16)23(13(2)24)18(21)12-14/h4-7,14,18,20H,8-12H2,1-3H3/b15-4+/t14-,18-,20-,21-/m1/s1
• InChIKey: CCNTUVFHVFQEJI-ULBRXFQASA-N

Properties

• Density: 1.25g/cm³ (Cal.)
• Boiling point: 539.517°C at 760 mmHg (Cal.)
• Flash point: 280.09°C (Cal.)