1-(N-(N-(N2-(5-Oxo-L-prolyl)-L-prolyl)-L-tryptophyl)-L-alanyl)-L-Proline
[CAS# 30505-63-6]

Identification

• Name: 1-(N-(N-(N2-(5-Oxo-L-prolyl)-L-prolyl)-L-tryptophyl)-L-alanyl)-L-Proline
• Synonyms: (2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-6-Amino-1-Oxo-2-[[Oxo-[(2S)-5-Oxo-2-Pyrrolidinyl]Methyl]Amino]Hexyl]Amino]-3-(1H-Indol-3-Yl)-1-Oxopropyl]Amino]-1-Oxopropyl]-2-Pyrrolidinecarboxylic Acid; (2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-6-Amino-2-(Pyroglutamoylamino)Hexanoyl]Amino]-3-(1H-Indol-3-Yl)Propanoyl]Amino]Propanoyl]Proline; (2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-6-Amino-2-[[(2S)-5-Oxopyrrolidin-2-Yl]Carbonylamino]Hexanoyl]Amino]-3-(1H-Indol-3-Yl)Propanoyl]Amino]Propanoyl]Pyrrolidine-2-Carboxylic Acid
• Molecular Formula: C₃₀H₄₁N₇O₇
• Molecular Weight: 611.70
• CAS Registry Number: 30505-63-6
• SMILES: [C@@H]4(N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1NC(=O)CC1)CCCCN)CC2=C[NH]C3=C2C=CC=C3)C)CCC4)C(=O)O
• InChI: 1S/C30H41N7O7/c1-17(29(42)37-14-6-10-24(37)30(43)44)33-28(41)23(15-18-16-32-20-8-3-2-7-19(18)20)36-26(39)21(9-4-5-13-31)35-27(40)22-11-12-25(38)34-22/h2-3,7-8,16-17,21-24,32H,4-6,9-15,31H2,1H3,(H,33,41)(H,34,38)(H,35,40)(H,36,39)(H,43,44)/t17-,21-,22-,23-,24-/m0/s1
• InChIKey: NINBLKUXZROFMZ-KELSAIANSA-N

Properties

• Density: 1.346g/cm³ (Cal.)
• Boiling point: 1122.753°C at 760 mmHg (Cal.)
• Flash point: 632.818°C (Cal.)