N-Palmitoyl-5,6-Dipalmitoyl-S-Glycerylcysteinyl-Seryl-Serine
[CAS# 98633-82-0]

Identification

• Name: N-Palmitoyl-5,6-Dipalmitoyl-S-Glycerylcysteinyl-Seryl-Serine
• Synonyms: (2S)-2-[[(2S)-2-[[(2R)-3-[2,3-Di(Hexadecanoyloxy)Propylsulfanyl]-2-(Hexadecanoylamino)Propanoyl]Amino]-3-Hydroxy-Propanoyl]Amino]-3-Hydroxy-Propanoic Acid; (2S)-2-[[(2S)-2-[[(2R)-3-[2,3-Bis(1-Oxohexadecoxy)Propylthio]-1-Oxo-2-(1-Oxohexadecylamino)Propyl]Am
• Molecular Formula: C₆₀H₁₁₃N₃O₁₁S
• Molecular Weight: 1084.63
• CAS Registry Number: 98633-82-0
• SMILES: [C@@H](NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCC)CSCC(OC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)(C(=O)N[C@H](C(=O)O)CO)CO
• InChI: 1S/C60H113N3O11S/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-55(66)61-54(59(70)62-52(46-64)58(69)63-53(47-65)60(71)72)50-75-49-51(74-57(68)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)48-73-56(67)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h51-54,64-65H,4-50H2,
• InChIKey: XVQKZSLOGHBCET-INVHGPFASA-N

Properties

• Density: 1.034g/cm³ (Cal.)
• Boiling point: 1102.496°C at 760 mmHg (Cal.)
• Flash point: 620.567°C (Cal.)