7-[(1Z)-1,3-Butadienyl]-2-[(2Z)-2-Penten-4-Ynyl]-1-Azaspiro[5.5]Undecan-8-Ol
[CAS# 55475-52-0]

Identification

• Name: 7-[(1Z)-1,3-Butadienyl]-2-[(2Z)-2-Penten-4-Ynyl]-1-Azaspiro[5.5]Undecan-8-Ol
• Synonyms: 1-Azaspiro(5.5)Undecan-8-Ol, 7-(1,3-Butadienyl)-2-(2-Penten-4-Ynyl)-, (6R-(6Alpha(2S*(Z)),7Beta(Z),8Alpha))-; Neodihydrohistrionicotoxin
• Molecular Formula: C₁₉H₂₇NO
• Molecular Weight: 285.43
• CAS Registry Number: 55475-52-0
• SMILES: [C@]12(N[C@H](C\C=C/C#C)CCC1)[C@H](\C=C/C=C)[C@@H](O)CCC2
• InChI: 1S/C19H27NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h1,4-7,12,16-18,20-21H,2,8-11,13-15H2/b7-5-,12-6-/t16-,17-,18+,19-/m1/s1
• InChIKey: FQIWPVJJYOOITJ-AFVFYVOOSA-N