Bikhaconitine
[CAS# 6078-26-8]

Identification

• Name: Bikhaconitine
• Synonyms: C08664
• Molecular Formula: C₃₆H₅₁NO₁₁
• Molecular Weight: 673.80
• CAS Registry Number: 6078-26-8
• SMILES: [C@]46([C@@H]2C3[C@]1([C@H](CC[C@@]([C@H]1[C@H]2OC)(COC)CN3CC)OC)[C@H]7[C@@H]4[C@@H](OC(C5=CC(=C(C=C5)OC)OC)=O)[C@]([C@H](C6)OC)(O)C7)OC(=O)C
• InChI: 1S/C36H51NO11/c1-9-37-17-33(18-41-3)13-12-24(44-6)36-21-15-34(40)25(45-7)16-35(48-19(2)38,27(30(36)37)28(46-8)29(33)36)26(21)31(34)47-32(39)20-10-11-22(42-4)23(14-20)43-5/h10-11,14,21,24-31,40H,9,12-13,15-18H2,1-8H3/t21-,24+,25+,26-,27+,28+,29-,30?,31-,33+,34+,35-,36+/m1/s1
• InChIKey: CYIFGHJXUWZGSW-GRXCUHEDSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 706.5±60.0°C at 760 mmHg (Cal.)
• Flash point: 381.1±32.9°C (Cal.)