N-[4-[[3-[8-[6-(Acetyloxy)-3,5-dimethyl-4-heptenyl]-3-methyl-1,7-dioxaspiro[5.5]undec-2-yl]propyl]amino]-2-hydroxy-3-methyl-4-oxobutyl]tetrahydro-3-methyl-6-(2-oxo-3-pentenyl)-2H-Pyran-2-acetamide
[CAS# 120853-14-7]

Identification

• Name: N-[4-[[3-[8-[6-(Acetyloxy)-3,5-dimethyl-4-heptenyl]-3-methyl-1,7-dioxaspiro[5.5]undec-2-yl]propyl]amino]-2-hydroxy-3-methyl-4-oxobutyl]tetrahydro-3-methyl-6-(2-oxo-3-pentenyl)-2H-Pyran-2-acetamide
• Synonyms: [(E)-6-[2-[3-[[3-Hydroxy-2-Methyl-4-[[2-[3-Methyl-6-[(E)-2-Oxopent-3-Enyl]Tetrahydropyran-2-Yl]Acetyl]Amino]Butanoyl]Amino]Propyl]-3-Methyl-1,7-Dioxaspiro[5.5]Undecan-8-Yl]-1,2,4-Trimethyl-Hex-2-Enyl] Acetate; Acetic Acid [(E)-6-[2-[3-[[3-Hydroxy-2-Methyl-4-[[2-[3-Methyl-6-[(E)-2-Oxopent-3-Enyl]-2-Tetrahydropyranyl]-1-Oxoethyl]Amino]-1-Oxobutyl]Amino]Propyl]-3-Methyl-1,7-Dioxaspiro[5.5]Undecan-8-Yl]-1,2,4-Trimethylhex-2-Enyl] Ester; Acetic Acid [(E)-6-[2-[3-[[3-Hydroxy-4-[[2-[6-[(E)-2-Ketopent-3-Enyl]-3-Methyl-Tetrahydropyran-2-Yl]Acetyl]Amino]-2-Methyl-Butanoyl]Amino]Propyl]-3-Methyl-1,7-Dioxaspiro[5.5]Undecan-8-Yl]-1,2,4-Trimethyl-Hex-2-Enyl] Ester
• Molecular Formula: C₄₂H₇₀N₂O₉
• Molecular Weight: 747.02
• CAS Registry Number: 120853-14-7
• SMILES: C(C2OC1(OC(CCC1)CCC(\C=C(C(OC(=O)C)C)/C)C)CCC2C)CCNC(=O)C(C(O)CNC(=O)CC3OC(CCC3C)CC(=O)\C=C\C)C
• InChI: 1S/C42H70N2O9/c1-9-12-34(46)24-36-18-16-28(3)39(51-36)25-40(48)44-26-37(47)31(6)41(49)43-22-11-14-38-29(4)19-21-42(53-38)20-10-13-35(52-42)17-15-27(2)23-30(5)32(7)50-33(8)45/h9,12,23,27-29,31-32,35-39,47H,10-11,13-22,24-26H2,1-8H3,(H,43,49)(H,44,48)/b12-9+,30-23+
• InChIKey: KMZCFBWHAZZXAJ-JQGVWWMCSA-N

Properties

• Density: 1.113g/cm³ (Cal.)
• Boiling point: 882.658°C at 760 mmHg (Cal.)
• Flash point: 487.614°C (Cal.)