L-Asparaginyl-L-prolyl-L-phenylalanyl-L-histidyl-L-alanyl-L-tryptophyl-Glycinamide
[CAS# 157623-03-5]

Identification

• Name: L-Asparaginyl-L-prolyl-L-phenylalanyl-L-histidyl-L-alanyl-L-tryptophyl-Glycinamide
• Synonyms: (2S)-N-[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-2-[(2-Amino-2-Oxo-Ethyl)Amino]-1-(1H-Indol-3-Ylmethyl)-2-Oxo-Ethyl]Amino]-1-Methyl-2-Oxo-Ethyl]Amino]-1-(3H-Imidazol-4-Ylmethyl)-2-Oxo-Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]-1-[(2S)-2,4-Diamino-4-Oxo-Butanoyl]Pyrrolidine-2-Carboxamide; (2S)-N-[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-2-[(2-Amino-2-Oxoethyl)Amino]-1-(1H-Indol-3-Ylmethyl)-2-Oxoethyl]Amino]-1-Methyl-2-Oxoethyl]Amino]-1-(3H-Imidazol-4-Ylmethyl)-2-Oxoethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]-1-[(2S)-2,4-Diamino-1,4-Dioxobutyl]-2-Pyrrolidinecarboxamide; (2S)-N-[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1S)-2-[(2-Amino-2-Keto-Ethyl)Amino]-1-(1H-Indol-3-Ylmethyl)-2-Keto-Ethyl]Amino]-2-Keto-1-Methyl-Ethyl]Amino]-1-(3H-Imidazol-4-Ylmethyl)-2-Keto-Ethyl]Amino]-1-(Benzyl)-2-Keto-Ethyl]-1-[(2S)-2,4-Diamino-4-Keto-Butanoyl]Pyrrolidine-2-Carboxamide
• Molecular Formula: C₄₀H₅₀N₁₂O₈
• Molecular Weight: 826.91
• CAS Registry Number: 157623-03-5
• SMILES: [C@@H]1(N(C(=O)[C@@H](N)CC(=O)N)CCC1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC2=C[NH]C3=C2C=CC=C3)C(=O)NCC(=O)N)C)CC4=CN=C[NH]4)CC5=CC=CC=C5
• InChI: 1S/C40H50N12O8/c1-22(35(55)49-30(36(56)46-20-34(43)54)15-24-18-45-28-11-6-5-10-26(24)28)48-37(57)31(16-25-19-44-21-47-25)50-38(58)29(14-23-8-3-2-4-9-23)51-39(59)32-12-7-13-52(32)40(60)27(41)17-33(42)53/h2-6,8-11,18-19,21-22,27,29-32,45H,7,12-17,20,41H2,1H3,(H2,42,53)(H2,43,54)(H,44,47)(H,46,56)(H,48,57)(H,49,55)(H,50,58)(H,51,59)/t22-,27-,29-,30-,31-,32-/m0/s1
• InChIKey: UNIMMWBGHPQJGU-ZGTZUYPNSA-N

Properties

• Density: 1.388g/cm³ (Cal.)
• Boiling point: 1455.705°C at 760 mmHg (Cal.)
• Flash point: 834.18°C (Cal.)