L-Methionyl-L-a-glutamyl-L-histidyl-L-Phenylalanine
[CAS# 50842-42-7]

Identification

• Name: L-Methionyl-L-a-glutamyl-L-histidyl-L-Phenylalanine
• Synonyms: (4S)-4-Amino-2-[(2S)-2-Amino-3-[[(1S)-2-[[(1S)-2-Hydroxy-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-1-(4H-Imidazol-4-Ylmethyl)-2-Oxo-Ethyl]Amino]-3-Oxo-Propyl]-6-Methylsulfanyl-3-Oxo-Hexanoic Acid; (4S)-4-Amino-2-[(2S)-2-Amino-3-[[(1S)-2-[[(1S)-2-Hydroxy-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-1-(4H-Imidazol-4-Ylmethyl)-2-Oxoethyl]Amino]-3-Oxopropyl]-6-(Methylthio)-3-Oxohexanoic Acid; (4S)-4-Amino-2-[(2S)-2-Amino-3-[[(1S)-2-[[(1S)-1-(Benzyl)-2-Hydroxy-2-Keto-Ethyl]Amino]-1-(4H-Imidazol-4-Ylmethyl)-2-Keto-Ethyl]Amino]-3-Keto-Propyl]-3-Keto-6-(Methylthio)Hexanoic Acid
• Molecular Formula: C₂₅H₃₄N₆O₇S
• Molecular Weight: 562.64
• CAS Registry Number: 50842-42-7
• SMILES: [C@@H](NC(=O)[C@@H](N)CC(C(=O)[C@@H](N)CCSC)C(=O)O)(C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)CC2N=CN=C2
• InChI: 1S/C25H34N6O7S/c1-39-8-7-17(26)21(32)16(24(35)36)11-18(27)22(33)30-19(10-15-12-28-13-29-15)23(34)31-20(25(37)38)9-14-5-3-2-4-6-14/h2-6,12-13,15-20H,7-11,26-27H2,1H3,(H,30,33)(H,31,34)(H,35,36)(H,37,38)/t15?,16?,17-,18-,19-,20-/m0/s1
• InChIKey: KQLBIAPXHRBJMR-UDNSVAPOSA-N

Properties

• Density: 1.464g/cm³ (Cal.)