(2S)-2-azanyl-6-azanylidene-N-[(2S,3R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-(1H-indol-3-yl)-3-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]hexanamide

Systemtic Name: (2S)-2-azanyl-6-azanylidene-N-[(2S,3R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-(1H-indol-3-yl)-3-oxidanylidene-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3-oxidanyl-1-oxidanylidene-butan-2-yl]hexanamide Openeye Name: (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-oxo-ethyl]amino]-2-oxo-ethyl]amino]-2-oxo-ethyl]carbamoyl]-2-hydroxy-propyl]-6-imino-hexanamide CAS 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 IUPAC 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 Traditional Name: (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 Formula: C48H56N8O7 MolecularWeight: 857.00764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)NC(CC4=CNC5=CC=CC=C54)C=O)NC(=O)C(CCCC=N)N)O

Isomeric SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@H](CC4=CNC5=CC=CC=C54)C=O)NC(=O)[C@H](CCCC=N)N)O

InChI

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