N-[(E)-1-[3,4-Dihydroxy-5-[5-Hydroxy-6-(Hydroxymethyl)-4-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-3-(3,4,5-Trihydroxyoxan-2-Yl)Oxyoxan-2-Yl]Oxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-3-Hydroxyoctadec-4-En-2-Yl]Tetracosanamide
[CAS# 128376-90-9]

Identification

• Name: N-[(E)-1-[3,4-Dihydroxy-5-[5-Hydroxy-6-(Hydroxymethyl)-4-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-3-(3,4,5-Trihydroxyoxan-2-Yl)Oxyoxan-2-Yl]Oxy-6-(Hydroxymethyl)Oxan-2-Yl]Oxy-3-Hydroxyoctadec-4-En-2-Yl]Tetracosanamide
• Synonyms: N-[(E)-1-[[3,4-Dihydroxy-5-[5-Hydroxy-6-(Hydroxymethyl)-4-[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-3-(3,4,5-Trihydroxytetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxymethyl]-2-Hydroxy-Heptadec-3-Enyl]Tetracosanamide; N-[(E)-1-[[3,4-Dihydroxy-5-[[5-Hydroxy-6-(Hydroxymethyl)-4-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-3-[(3,4,5-Trihydroxy-2-Tetrahydropyranyl)Oxy]-2-Tetrahydropyranyl]Oxy]-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxymethyl]-2-Hydroxyheptadec-3-Enyl]Tetracosanamide; N-[(E)-1-[[3,4-Dihydroxy-5-[5-Hydroxy-6-Methylol-4-(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxy-3-(3,4,5-Trihydroxytetrahydropyran-2-Yl)Oxy-Tetrahydropyran-2-Yl]Oxy-6-Methylol-Tetrahydropyran-2-Yl]Oxymethyl]-2-Hydroxy-Heptadec-3-Enyl]Lignoceramide
• Molecular Formula: C₆₅H₁₂₁NO₂₂
• Molecular Weight: 1268.66
• CAS Registry Number: 128376-90-9
• SMILES: C(O)C4OC(OC1C(O)C(O)C(OC1CO)OCC(NC(=O)CCCCCCCCCCCCCCCCCCCCCCC)C(O)\C=C\CCCCCCCCCCCCC)C(OC2OCC(O)C(O)C2O)C(OC3OC(C(O)C(O)C3O)CO)C4O
• InChI: 1S/C65H121NO22/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-50(72)66-44(45(70)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2)42-81-62-58(80)55(77)59(49(41-69)85-62)86-65-61(88-63-56(78)51(73)46(71)43-82-63)60(53(75)48(40-68)84-65)87-64-57(79)54(76)52(74)47(39-67)83-64/h35,37,44-49,51-65,67-71,73-80H,3-34,36,38-43H2,1-2H3,(H,66,72)/b37-35+
• InChIKey: XDWZRGWUGSQHEW-MHAUTQJVSA-N

Properties

• Density: 1.24g/cm³ (Cal.)
• Boiling point: 1250.465°C at 760 mmHg (Cal.)
• Flash point: 710.055°C (Cal.)