(2S)-2-[[2-[(2-Aminoacetyl)Amino]Acetyl]Amino]-3-(4H-Imidazol-4-Yl)-N-[2-[[(2S)-3-(4H-Imidazol-4-Yl)-1-[[2-[[(2S)-1-(4H-Imidazol-4-Yl)-3-Oxopropan-2-Yl]Amino]-2-Oxoethylidene]Amino]-1-Oxopropan-2-Yl]Amino]-2-Oxoethyl]Propanamide
[CAS# 75356-90-0]

Identification

• Name: (2S)-2-[[2-[(2-Aminoacetyl)Amino]Acetyl]Amino]-3-(4H-Imidazol-4-Yl)-N-[2-[[(2S)-3-(4H-Imidazol-4-Yl)-1-[[2-[[(2S)-1-(4H-Imidazol-4-Yl)-3-Oxopropan-2-Yl]Amino]-2-Oxoethylidene]Amino]-1-Oxopropan-2-Yl]Amino]-2-Oxoethyl]Propanamide
• Synonyms: (2S)-2-[[2-[(2-Aminoacetyl)Amino]Acetyl]Amino]-N-[2-[[(1S)-2-[[2-[[(1S)-1-Formyl-2-(4H-Imidazol-4-Yl)Ethyl]Amino]-2-Oxo-Ethylidene]Amino]-1-(4H-Imidazol-4-Ylmethyl)-2-Oxo-Ethyl]Amino]-2-Oxo-Ethyl]-3-(4H-Imidazol-4-Yl)Propanamide; (2S)-2-[[2-[(2-Amino-1-Oxoethyl)Amino]-1-Oxoethyl]Amino]-N-[2-[[(1S)-2-[[2-[[(1S)-1-Formyl-2-(4H-Imidazol-4-Yl)Ethyl]Amino]-2-Oxoethylidene]Amino]-1-(4H-Imidazol-4-Ylmethyl)-2-Oxoethyl]Amino]-2-Oxoethyl]-3-(4H-Imidazol-4-Yl)Propanamide; (2S)-N-[2-[[(1S)-2-[[2-[[(1S)-1-Formyl-2-(4H-Imidazol-4-Yl)Ethyl]Amino]-2-Keto-Ethylidene]Amino]-1-(4H-Imidazol-4-Ylmethyl)-2-Keto-Ethyl]Amino]-2-Keto-Ethyl]-2-[[2-(Glycylamino)Acetyl]Amino]-3-(4H-Imidazol-4-Yl)Propionamide
• Molecular Formula: C₂₆H₃₃N₁₃O₇
• Molecular Weight: 639.63
• CAS Registry Number: 75356-90-0
• SMILES: [C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)CN)CC1N=CN=C1)(C(=O)N=CC(=O)N[C@@H](CC2N=CN=C2)C=O)CC3N=CN=C3
• InChI: 1S/C26H33N13O7/c27-4-21(41)31-8-23(43)38-19(2-16-6-29-13-35-16)26(46)33-10-24(44)39-20(3-17-7-30-14-36-17)25(45)32-9-22(42)37-18(11-40)1-15-5-28-12-34-15/h5-7,9,11-20H,1-4,8,10,27H2,(H,31,41)(H,33,46)(H,37,42)(H,38,43)(H,39,44)/t15?,16?,17?,18-,19-,20-/m0/s1
• InChIKey: WSBDFLLOOXCAMJ-GAKWCIEDSA-N

Properties

• Density: 1.604g/cm³ (Cal.)