N-(N-(N-glycyl-D-phenylalanyl)-L-alanyl)-L-Aspartic acid
[CAS# 121912-19-4]

Identification

• Name: N-(N-(N-glycyl-D-phenylalanyl)-L-alanyl)-L-Aspartic acid
• Synonyms: (2S)-2-[[(2S)-2-[[(2R)-2-[(2-Aminoacetyl)Amino]-3-Phenyl-Propanoyl]Amino]Propanoyl]Amino]Butanedioic Acid; (2S)-2-[[(2S)-2-[[(2R)-2-[(2-Amino-1-Oxoethyl)Amino]-1-Oxo-3-Phenylpropyl]Amino]-1-Oxopropyl]Amino]Butanedioic Acid; (2S)-2-[[(2S)-2-[[(2R)-2-(Glycylamino)-3-Phenyl-Propanoyl]Amino]Propanoyl]Amino]Succinic Acid
• Molecular Formula: C₁₈H₂₄N₄O₇
• Molecular Weight: 408.41
• CAS Registry Number: 121912-19-4
• SMILES: [C@H](NC([C@@H](NC([C@H](NC(=O)CN)CC1=CC=CC=C1)=O)C)=O)(CC(=O)O)C(=O)O
• InChI: 1S/C18H24N4O7/c1-10(16(26)22-13(18(28)29)8-15(24)25)20-17(27)12(21-14(23)9-19)7-11-5-3-2-4-6-11/h2-6,10,12-13H,7-9,19H2,1H3,(H,20,27)(H,21,23)(H,22,26)(H,24,25)(H,28,29)/t10-,12+,13-/m0/s1
• InChIKey: ZCPBEAHAVUJKAE-UHTWSYAYSA-N

Properties

• Density: 1.365g/cm³ (Cal.)
• Boiling point: 821.575°C at 760 mmHg (Cal.)
• Flash point: 450.672°C (Cal.)