Veratrine
[CAS# 8051-02-3]

Identification

• Name: Veratrine
• Synonyms: Spectrum5_000608; Bspbio_003121; .Alpha.-Veratrine
• Molecular Formula: C₃₂H₄₉NO₉
• Molecular Weight: 591.74
• CAS Registry Number: 8051-02-3
• SMILES: [C@@]137[C@@]2([C@@H]([C@](O1)([C@@H](OC(C(=C\C)/C)=O)CC2)O)CC[C@H]3[C@]6([C@]([C@H]4[C@@]([C@@]([C@H]5N(C4)C[C@H](CC5)C)(O)C)([C@H](C6)O)O)(C7)O)O)C
• InChI: 1S/C32H49NO9/c1-6-18(3)25(35)41-24-11-12-26(4)19-8-9-20-28(37)13-23(34)31(39)21(29(28,38)16-30(20,26)42-32(19,24)40)15-33-14-17(2)7-10-22(33)27(31,5)36/h6,17,19-24,34,36-40H,7-16H2,1-5H3/b18-6-/t17-,19-,20-,21-,22-,23-,24-,26-,27+,28+,29+,30+,31-,32-/m0/s1
• InChIKey: DBUCFOVFALNEOO-HWBIYQLFSA-N

Properties

• Density: 1.413g/cm³ (Cal.)
• Boiling point: 733.342°C at 760 mmHg (Cal.)
• Flash point: 397.311°C (Cal.)