3-[2-Hydroxy-7-[5-[(E)-1,4,5-Trihydroxyhenicos-8-Enyl]Oxolan-2-Yl]Heptyl]-5-Methyl-5H-Furan-2-One
[CAS# 145403-31-2]

Identification

• Name: 3-[2-Hydroxy-7-[5-[(E)-1,4,5-Trihydroxyhenicos-8-Enyl]Oxolan-2-Yl]Heptyl]-5-Methyl-5H-Furan-2-One
• Synonyms: 3-[2-Hydroxy-7-[5-[(E)-1,4,5-Trihydroxyhenicos-8-Enyl]Tetrahydrofuran-2-Yl]Heptyl]-5-Methyl-5H-Furan-2-One; 3-[2-Hydroxy-7-[5-[(E)-1,4,5-Trihydroxyhenicos-8-Enyl]-2-Tetrahydrofuranyl]Heptyl]-5-Methyl-5H-Furan-2-One; Gigantetronenin
• Molecular Formula: C₃₇H₆₆O₇
• Molecular Weight: 622.92
• CAS Registry Number: 145403-31-2
• SMILES: C(C1=CC(OC1=O)C)C(O)CCCCCC2OC(C(O)CCC(O)C(O)CC\C=C\CCCCCCCCCCCC)CC2
• InChI: 1S/C37H66O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-22-33(39)34(40)24-25-35(41)36-26-23-32(44-36)21-18-16-17-20-31(38)28-30-27-29(2)43-37(30)42/h14-15,27,29,31-36,38-41H,3-13,16-26,28H2,1-2H3/b15-14+
• InChIKey: LFIZQGRMDGWRQH-CCEZHUSRSA-N

Properties

• Density: 1.043g/cm³ (Cal.)
• Boiling point: 776.668°C at 760 mmHg (Cal.)
• Flash point: 230.573°C (Cal.)