3-[6-(2,5-Dihydro-4-Hydroxy-2-Oxo-1H-Pyrrol-3-Yl)-1,3-Dimethyl-6-Oxohexa-2,4-Dienyl]-alpha,1,4-Trimethyl-6-Oxospiro[2,9-Dioxabicyclo[3.3.1]Nonane-8,2'-Oxirane]-3'-Acetic Acid Methyl Ester
[CAS# 63748-09-4]

Identification

• Name: 3-[6-(2,5-Dihydro-4-Hydroxy-2-Oxo-1H-Pyrrol-3-Yl)-1,3-Dimethyl-6-Oxohexa-2,4-Dienyl]-alpha,1,4-Trimethyl-6-Oxospiro[2,9-Dioxabicyclo[3.3.1]Nonane-8,2'-Oxirane]-3'-Acetic Acid Methyl Ester
• Synonyms: Methyl 2-[7-[(2E,4E)-6-(2-Hydroxy-4-Oxo-1,5-Dihydropyrrol-3-Yl)-1,3-Dimethyl-6-Oxo-Hexa-2,4-Dienyl]-1,6-Dimethyl-4-Oxo-Spiro[8,9-Dioxabicyclo[3.3.1]Nonane-2,3'-Oxirane]-2'-Yl]Propanoate; 2-[7-[(2E,4E)-6-(2-Hydroxy-4-Oxo-1,5-Dihydropyrrol-3-Yl)-1,3-Dimethyl-6-Oxohexa-2,4-Dienyl]-1,6-Dimethyl-4-Oxo-2'-Spiro[8,9-Dioxabicyclo[3.3.1]Nonane-2,3'-Oxirane]Yl]Propanoic Acid Methyl Ester; 2-[7-[(2E,4E)-6-(2-Hydroxy-4-Keto-2-Pyrrolin-3-Yl)-6-Keto-1,3-Dimethyl-Hexa-2,4-Dienyl]-4-Keto-1,6-Dimethyl-Spiro[8,9-Dioxabicyclo[3.3.1]Nonane-2,3'-Oxirane]-2'-Yl]Propionic Acid Methyl Ester
• Molecular Formula: C₂₆H₃₃NO₉
• Molecular Weight: 503.55
• CAS Registry Number: 63748-09-4
• SMILES: CC13OC(C(C(O1)C(C)\C=C(C)\C=C\C(=O)C2=C(O)NCC2=O)C)C(=O)CC34OC4C(C)C(OC)=O
• InChI: 1S/C26H33NO9/c1-12(7-8-16(28)19-18(30)11-27-23(19)31)9-13(2)20-14(3)21-17(29)10-26(25(5,34-20)35-21)22(36-26)15(4)24(32)33-6/h7-9,13-15,20-22,27,31H,10-11H2,1-6H3/b8-7+,12-9+
• InChIKey: BVRFKRRTEUQPDN-ANKZSMJWSA-N

Properties

• Density: 1.326g/cm³ (Cal.)
• Boiling point: 628.345°C at 760 mmHg (Cal.)
• Flash point: 333.811°C (Cal.)