Dihydropicrotoxinin
[CAS# 17617-46-8]

Identification

• Name: Dihydropicrotoxinin
• Synonyms: Hexahydro-2A-Hydroxy-8B-Methyl-9-(1-Methylethyl)-3,6-Methano-8H-1,5,7-Trioxacyclopenta(Ij)Cycloprop(A)Azulene-4,8(3H)-Dione (1Ar-(1Aalpha,2Abeta,3Beta,6Beta,6Abeta,8As*,8Bbeta,9S*))-; Picrotoxinin, Alpha-Dihydro-; Dihydropicrotoxinin
• Molecular Formula: C₁₅H₁₈O₆
• Molecular Weight: 294.30
• CAS Registry Number: 17617-46-8
• SMILES: [C@@]24(C15OC1C[C@@]2(O)[C@@H]3C(C(OC3=O)[C@H]4OC5=O)C(C)C)C
• InChI: 1S/C15H18O6/c1-5(2)7-8-11(16)19-9(7)10-13(3)14(8,18)4-6-15(13,21-6)12(17)20-10/h5-10,18H,4H2,1-3H3/t6?,7?,8-,9?,10-,13-,14-,15?/m1/s1
• InChIKey: SJSFJVFGSPJGET-KJINDDCRSA-N

Properties

• Density: 1.494g/cm³ (Cal.)
• Boiling point: 539.007°C at 760 mmHg (Cal.)
• Flash point: 207.728°C (Cal.)