N-(N-(N-(N-(1-Oxodecyl)glycyl)-L-tryptophyl)-L-alanyl)-L-Alanine methyl ester
[CAS# 19716-78-0]

Identification

• Name: N-(N-(N-(N-(1-Oxodecyl)glycyl)-L-tryptophyl)-L-alanyl)-L-Alanine methyl ester
• Synonyms: 2-[[2-[[3-(1H-Indol-3-Yl)-1-Oxo-2-[[1-Oxo-2-(1-Oxodecylamino)Ethyl]Amino]Propyl]Amino]-1-Oxopropyl]Amino]Propanoic Acid Methyl Ester; 2-[2-[[2-[[2-(Caprylamino)Acetyl]Amino]-3-(1H-Indol-3-Yl)Propanoyl]Amino]Propanoylamino]Propionic Acid Methyl Ester; Methyl 2-[2-[[2-[2-(Decanoylamino)Ethanoylamino]-3-(1H-Indol-3-Yl)Propanoyl]Amino]Propanoylamino]Propanoate
• Molecular Formula: C₃₀H₄₅N₅O₆
• Molecular Weight: 571.72
• CAS Registry Number: 19716-78-0
• SMILES: C1=C(CC(C(NC(C(NC(C(OC)=O)C)=O)C)=O)NC(CNC(CCCCCCCCC)=O)=O)C2=C([NH]1)C=CC=C2
• InChI: 1S/C30H45N5O6/c1-5-6-7-8-9-10-11-16-26(36)32-19-27(37)35-25(17-22-18-31-24-15-13-12-14-23(22)24)29(39)33-20(2)28(38)34-21(3)30(40)41-4/h12-15,18,20-21,25,31H,5-11,16-17,19H2,1-4H3,(H,32,36)(H,33,39)(H,34,38)(H,35,37)
• InChIKey: MPMCVDLITHVKGR-UHFFFAOYSA-N

Properties

• Density: 1.159g/cm³ (Cal.)
• Boiling point: 898.452°C at 760 mmHg (Cal.)
• Flash point: 497.166°C (Cal.)