2-[3-[(E)-but-1-enyl]oxiran-2-yl]-6-hydroxy-7-methoxy-3-methyl-7-phenylcarbonyl-1-oxa-8-azaspiro[4.4]non-2-ene-4,9-dione
[CAS# 127941-81-5]

Identification

• Name: 2-[3-[(E)-but-1-enyl]oxiran-2-yl]-6-hydroxy-7-methoxy-3-methyl-7-phenylcarbonyl-1-oxa-8-azaspiro[4.4]non-2-ene-4,9-dione
• Synonyms: 2-[3-[(E)-But-1-Enyl]-2-Oxiranyl]-6-Hydroxy-7-Methoxy-3-Methyl-7-(Oxo-Phenylmethyl)-1-Oxa-8-Azaspiro[4.4]Non-2-Ene-4,9-Dione; 7-(Benzoyl)-2-[3-[(E)-But-1-Enyl]Oxiran-2-Yl]-6-Hydroxy-7-Methoxy-3-Methyl-1-Oxa-8-Azaspiro[4.4]Non-2-Ene-4,9-Quinone; 2-[3-[(E)-But-1-Enyl]Oxiran-2-Yl]-6-Hydroxy-7-Methoxy-3-Methyl-7-Phenylcarbonyl-1-Oxa-8-Azaspiro[4.4]Non-2-Ene-4,9-Dione
• Molecular Formula: C₂₂H₂₃NO₇
• Molecular Weight: 413.43
• CAS Registry Number: 127941-81-5
• SMILES: C4=C(C(=O)C3(OC)NC(=O)C1(OC(=C(C1=O)C)C2OC2\C=C\CC)C3O)C=CC=C4
• InChI: 1S/C22H23NO7/c1-4-5-11-14-16(29-14)15-12(2)17(24)21(30-15)19(26)22(28-3,23-20(21)27)18(25)13-9-7-6-8-10-13/h5-11,14,16,19,26H,4H2,1-3H3,(H,23,27)/b11-5+
• InChIKey: UCUHTBUWKCQZNJ-VZUCSPMQSA-N

Properties

• Density: 1.387g/cm³ (Cal.)
• Boiling point: 684.763°C at 760 mmHg (Cal.)
• Flash point: 367.932°C (Cal.)