(2S)-2-Amino-N-[(2S,3R)-3-Hydroxy-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-(1H-Indol-3-Yl)-3-Oxopropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]Amino]-1-Oxobutan-2-Yl]-6-Iminohexanamide
[CAS# 72127-61-8]

Identification

• Name: (2S)-2-Amino-N-[(2S,3R)-3-Hydroxy-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-(1H-Indol-3-Yl)-3-Oxopropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]Amino]-1-Oxo-3-Phenylpropan-2-Yl]Amino]-1-Oxobutan-2-Yl]-6-Iminohexanamide
• Synonyms: (2S)-2-Amino-N-[(1S,2R)-1-[[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1R)-1-Formyl-2-(1H-Indol-3-Yl)Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Carbamoyl]-2-Hydroxy-Propyl]-6-Imino-Hexanamide; (2S)-2-Amino-N-[(1S,2R)-1-[[[(1S)-2-[[(1S)-2-[[(1S)-2-[[(1R)-1-Formyl-2-(1H-Indol-3-Yl)Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-Oxomethyl]-2-Hydroxypropyl]-6-Iminohexanamide; (2S)-2-Amino-N-[(1S,2R)-1-[[(1S)-1-(Benzyl)-2-[[(1S)-1-(Benzyl)-2-[[(1S)-1-(Benzyl)-2-[[(1R)-1-Formyl-2-(1H-Indol-3-Yl)Ethyl]Amino]-2-Keto-Ethyl]Amino]-2-Keto-Ethyl]Amino]-2-Keto-Ethyl]Carbamoyl]-2-Hydroxy-Propyl]-6-Imino-Hexanamide
• Molecular Formula: C₄₈H₅₆N₈O₇
• Molecular Weight: 857.02
• CAS Registry Number: 72127-61-8
• SMILES: [C@@H](C=O)(NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CCCC=N)=O)[C@@H](C)O)=O)CC1=CC=CC=C1)=O)CC2=CC=CC=C2)=O)CC3=CC=CC=C3)=O)CC4=C[NH]C5=CC=CC=C45
• InChI: 1S/C48H56N8O7/c1-31(58)43(56-44(59)38(50)22-13-14-24-49)48(63)55-42(27-34-19-9-4-10-20-34)47(62)54-41(26-33-17-7-3-8-18-33)46(61)53-40(25-32-15-5-2-6-16-32)45(60)52-36(30-57)28-35-29-51-39-23-12-11-21-37(35)39/h2-12,15-21,23-24,29-31,36,38,40-43,49,51,58H,13-14,22,25-28,50H2,1H3,(H,52,60)(H,53,61)(H,54,62)(H,55,63)(H,56,59)/t31-,36-,38+,40+,41+,42+,43+/m1/s1
• InChIKey: JPKJQBJPBRLVTM-OSLIGDBKSA-N