[(2R)-3-[[2-Amino-3-Hydroxy-2-(Hydroxymethyl)Propoxy]-Hydroxyphosphoryl]Oxy-2-[(Z)-Octadec-9-Enoyl]Oxypropyl] (E)-Octadec-9-Enoate
[CAS# 131235-28-4]

Identification

• Name: [(2R)-3-[[2-Amino-3-Hydroxy-2-(Hydroxymethyl)Propoxy]-Hydroxyphosphoryl]Oxy-2-[(Z)-Octadec-9-Enoyl]Oxypropyl] (E)-Octadec-9-Enoate
• Synonyms: [(2R)-3-[[2-Amino-3-Hydroxy-2-(Hydroxymethyl)Propoxy]-Hydroxy-Phosphoryl]Oxy-2-[(Z)-Octadec-9-Enoyl]Oxy-Propyl] (E)-Octadec-9-Enoate; (E)-Octadec-9-Enoic Acid [(2R)-3-[[2-Amino-3-Hydroxy-2-(Hydroxymethyl)Propoxy]-Hydroxyphosphoryl]Oxy-2-[(Z)-1-Oxooctadec-9-Enoxy]Propyl] Ester; (E)-Octadec-9-Enoic Acid [(2R)-3-[(2-Amino-3-Hydroxy-2-Methylol-Propoxy)-Hydroxy-Phosphoryl]Oxy-2-[(Z)-Octadec-9-Enoyl]Oxy-Propyl] Ester
• Molecular Formula: C₄₃H₈₂NO₁₀P
• Molecular Weight: 804.10
• CAS Registry Number: 131235-28-4
• SMILES: [C@@H](COC(CCCCCCC\C=C\CCCCCCCC)=O)(CO[P](=O)(O)OCC(CO)(CO)N)OC(CCCCCCC\C=C/CCCCCCCC)=O
• InChI: 1S/C43H82NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(47)51-35-40(36-52-55(49,50)53-39-43(44,37-45)38-46)54-42(48)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,40,45-46H,3-16,21-39,44H2,1-2H3,(H,49,50)/b19-17+,20-18-/t40-/m1/s1
• InChIKey: YIOFGSXRHXGDLX-NZFSMJPNSA-N

Properties

• Density: 1.05g/cm³ (Cal.)
• Boiling point: 823.565°C at 760 mmHg (Cal.)
• Flash point: 451.876°C (Cal.)