[5-[4-Hydroxy-3-(8-Hydroxy-2,5,9-Trimethyl-1-Oxo-2,4,9,12-Tetradecatetrenyl)-2-Oxo-2H-Pyran-6-Yl]-1-Hexenyl]Carbamic Acid Methyl Ester
[CAS# 93195-32-5]

Identification

• Name: [5-[4-Hydroxy-3-(8-Hydroxy-2,5,9-Trimethyl-1-Oxo-2,4,9,12-Tetradecatetrenyl)-2-Oxo-2H-Pyran-6-Yl]-1-Hexenyl]Carbamic Acid Methyl Ester
• Synonyms: Methyl N-[(E)-5-[6-Hydroxy-5-[(2E,4E,9Z,13E)-8-Hydroxy-2,5,9-Trimethyl-Pentadeca-2,4,9,13-Tetraenoyl]-4-Oxo-Pyran-2-Yl]Hex-1-Enyl]Carbamate; N-[(E)-5-[6-Hydroxy-5-[(2E,4E,9Z,13E)-8-Hydroxy-2,5,9-Trimethyl-1-Oxopentadeca-2,4,9,13-Tetraenyl]-4-Oxo-2-Pyranyl]
• Molecular Formula: C₃₁H₄₃NO₇
• Molecular Weight: 541.68
• CAS Registry Number: 93195-32-5
• SMILES: C(C(C1=CC(=O)C(=C(O1)O)C(=O)C(=C/C=C(/CCC(O)C(=C\CC\C=C\C)/C)C)/C)C)C\C=C\NC(OC)=O
• InChI: 1S/C31H43NO7/c1-7-8-9-10-13-22(3)25(33)18-16-21(2)15-17-24(5)29(35)28-26(34)20-27(39-30(28)36)23(4)14-11-12-19-32-31(37)38-6/h7-8,12-13,15,17,19-20,23,25,33,36H,9-11,14,16,18H2,1-6H3,(H,32,37)/b8-7+,19-12+,21-15+,22-13-,24-17+
• InChIKey: WXSGHDSVVDSQCP-SKFHZJMVSA-N

Properties

• Density: 1.13g/cm³ (Cal.)
• Boiling point: 709.957°C at 760 mmHg (Cal.)
• Flash point: 383.168°C (Cal.)