Protoverine
[CAS# 76-45-9]

Identification

• Name: Protoverine
• Synonyms: Protoverine; (3Beta,4Alpha,6Alpha,7Alpha,15Alpha,16Beta)-4,9-Epoxycevane-3,4,6,7,14,15,16,20-Octol
• Molecular Formula: C₂₇H₄₃NO₉
• Molecular Weight: 525.64
• CAS Registry Number: 76-45-9
• SMILES: [C@@]257[C@H]([C@@]1([C@H]([C@@H]([C@H]3[C@H]([C@@H]1C2)CN4[C@H]([C@]3(O)C)CC[C@@H](C4)C)O)O)O)[C@@H]([C@@H]([C@H]6[C@@]5(CC[C@@H]([C@]6(O7)O)O)C)O)O
• InChI: 1S/C27H43NO9/c1-11-4-5-14-24(3,34)16-12(10-28(14)9-11)13-8-25-21(26(13,35)22(33)17(16)30)19(32)18(31)20-23(25,2)7-6-15(29)27(20,36)37-25/h11-22,29-36H,4-10H2,1-3H3/t11-,12-,13-,14-,15-,16+,17+,18-,19+,20-,21+,22-,23-,24+,25+,26-,27+/m0/s1
• InChIKey: CKJAABZFXLMMCS-MKKPLVDTSA-N

Properties

• Density: 1.55g/cm³ (Cal.)
• Boiling point: 711.05°C at 760 mmHg (Cal.)
• Flash point: 383.829°C (Cal.)