cyclohexyl (4S)-4-[[(2R)-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]propanoyl]amino]-5-oxidanylidene-5-[[(2R)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]pentanoate

Systemtic Name: cyclohexyl (4S)-4-[[(2R)-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]propanoyl]amino]-5-oxidanylidene-5-[[(2R)-1-oxidanylidene-1-phenylmethoxy-propan-2-yl]amino]pentanoate Openeye Name: cyclohexyl (4S)-5-[[(1R)-2-benzyloxy-1-methyl-2-oxo-ethyl]amino]-4-[[(2R)-2-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanoyl]amino]propanoyl]amino]-5-oxo-pentanoate CAS Name: (4S)-4-[[(2R)-2-[[(2S)-4-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopentyl]amino]-1-oxopropyl]amino]-5-oxo-5-[[(2R)-1-oxo-1-phenylmethoxypropan-2-yl]amino]pentanoic acid cyclohexyl ester IUPAC Name: cyclohexyl (4S)-4-[[(2R)-2-[[(2S)-4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]propanoyl]amino]-5-oxo-5-[[(2R)-1-oxo-1-phenylmethoxypropan-2-yl]amino]pentanoate Traditional Name: (4S)-5-[[(1R)-2-benzoxy-2-keto-1-methyl-ethyl]amino]-4-[[(2R)-2-[[(2S)-2-(tert-butoxycarbonylamino)-4-methyl-pentanoyl]amino]propanoyl]amino]-5-keto-valeric acid cyclohexyl ester Formula: C35H54N4O9 MolecularWeight: 674.82466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(C)C(=O)NC(CCC(=O)OC1CCCCC1)C(=O)NC(C)C(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C(=O)N[C@@H](CCC(=O)OC1CCCCC1)C(=O)N[C@H](C)C(=O)OCC2=CC=CC=C2)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C35H54N4O9/c1-22(2)20-28(39-34(45)48-35(5,6)7)32(43)36-23(3)30(41)38-27(18-19-29(40)47-26-16-12-9-13-17-26)31(42)37-24(4)33(44)46-21-25-14-10-8-11-15-25/h8,10-11,14-15,22-24,26-28H,9,12-13,16-21H2,1-7H3,(H,36,43)(H,37,42)(H,38,41)(H,39,45)/t23-,24-,27+,28+/m1/s1