N-[(2R)-2-Hydroxy-1-oxopropyl]-L-alanyl-D-g-glutamyl-(6R)-6-carboxy-L-lysyl-Glycine
[CAS# 76490-22-7]

Identification

• Name: N-[(2R)-2-Hydroxy-1-oxopropyl]-L-alanyl-D-g-glutamyl-(6R)-6-carboxy-L-lysyl-Glycine
• Synonyms: (2R,6R)-2-Amino-7-(Carboxymethylamino)-6-[[5-Hydroxy-4-[[(2S)-2-[[(2R)-2-Hydroxypropanoyl]Amino]Propanoyl]Amino]-5-Oxo-Pentanoyl]Amino]-7-Oxo-Heptanoic Acid; (2R,6R)-2-Amino-7-(Carboxymethylamino)-6-[[5-Hydroxy-4-[[(2S)-2-[[(2R)-2-Hydroxy-1-Oxopropyl]Amino]-1-Oxopropyl]Amino]-1,5-Dioxopentyl]Amino]-7-Oxoheptanoic Acid; (2R,6R)-2-Amino-7-(Carboxymethylamino)-6-[[5-Hydroxy-5-Keto-4-[[(2S)-2-Lactamidopropanoyl]Amino]Pentanoyl]Amino]-7-Keto-Enanthic Acid
• Molecular Formula: C₂₀H₃₃N₅O₁₁
• Molecular Weight: 519.51
• CAS Registry Number: 76490-22-7
• SMILES: [C@H](NC(=O)CCC(NC(=O)[C@@H](NC(=O)[C@H](O)C)C)C(=O)O)(C(=O)NCC(=O)O)CCC[C@@H](N)C(=O)O
• InChI: 1S/C20H33N5O11/c1-9(23-17(31)10(2)26)16(30)25-13(20(35)36)6-7-14(27)24-12(18(32)22-8-15(28)29)5-3-4-11(21)19(33)34/h9-13,26H,3-8,21H2,1-2H3,(H,22,32)(H,23,31)(H,24,27)(H,25,30)(H,28,29)(H,33,34)(H,35,36)/t9-,10+,11+,12+,13?/m0/s1
• InChIKey: RNZKYQHTFUFVSS-ZLUZDFLPSA-N

Properties

• Density: 1.406g/cm³ (Cal.)
• Boiling point: 1084.989°C at 760 mmHg (Cal.)
• Flash point: 609.979°C (Cal.)