Cycloprotobuxine C
[CAS# 1936-70-5]

Identification

• Name: Cycloprotobuxine C
• Synonyms: Cycloprotobuxine C; Nci60_000063; Alkaloid L
• Molecular Formula: C₂₇H₄₈N₂
• Molecular Weight: 400.69
• CAS Registry Number: 1936-70-5
• SMILES: [C@]245[C@@]1([C@H](C(C)(C)[C@H](CC1)NC)CC[C@H]2[C@@]3(CC[C@@H]([C@]3(CC4)C)[C@@H](N(C)C)C)C)C5
• InChI: 1S/C27H48N2/c1-18(29(7)8)19-11-13-25(5)21-10-9-20-23(2,3)22(28-6)12-14-26(20)17-27(21,26)16-15-24(19,25)4/h18-22,28H,9-17H2,1-8H3/t18-,19+,20-,21-,22-,24+,25-,26+,27-/m0/s1
• InChIKey: PLKVWYPBRRRIQG-QGSMACLHSA-N

Properties

• Density: 1.012g/cm³ (Cal.)
• Boiling point: 466.559°C at 760 mmHg (Cal.)
• Flash point: 102.216°C (Cal.)