methyl (2R)-2-methyl-2-[[(2S)-2-methyl-2-[[(2R)-2-methyl-2-[[(2S)-2-methyl-2-(phenylmethoxycarbonylamino)-3-(phenylmethylsulfanyl)propanoyl]amino]-3-(phenylmethylsulfanyl)propanoyl]amino]-3-(phenylmethylsulfanyl)propanoyl]amino]-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: methyl (2R)-2-methyl-2-[[(2S)-2-methyl-2-[[(2R)-2-methyl-2-[[(2S)-2-methyl-2-(phenylmethoxycarbonylamino)-3-(phenylmethylsulfanyl)propanoyl]amino]-3-(phenylmethylsulfanyl)propanoyl]amino]-3-(phenylmethylsulfanyl)propanoyl]amino]-3-(phenylmethylsulfanyl)propanoate Openeye Name: methyl (2R)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-(benzyloxycarbonylamino)-3-benzylsulfanyl-2-methyl-propanoyl]amino]-3-benzylsulfanyl-2-methyl-propanoyl]amino]-3-benzylsulfanyl-2-methyl-propanoyl]amino]-3-benzylsulfanyl-2-methyl-propanoate CAS Name: (2R)-2-methyl-2-[[(2S)-2-methyl-2-[[(2R)-2-methyl-2-[[(2S)-2-methyl-1-oxo-2-(phenylmethoxycarbonylamino)-3-(phenylmethylthio)propyl]amino]-1-oxo-3-(phenylmethylthio)propyl]amino]-1-oxo-3-(phenylmethylthio)propyl]amino]-3-(phenylmethylthio)propanoic acid methyl ester IUPAC Name: methyl (2R)-3-benzylsulfanyl-2-[[(2S)-3-benzylsulfanyl-2-[[(2R)-3-benzylsulfanyl-2-[[(2S)-3-benzylsulfanyl-2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoate Traditional Name: (2R)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-(benzyloxycarbonylamino)-3-(benzylthio)-2-methyl-propanoyl]amino]-3-(benzylthio)-2-methyl-propanoyl]amino]-3-(benzylthio)-2-methyl-propanoyl]amino]-3-(benzylthio)-2-methyl-propionic acid methyl ester Formula: C53H62N4O7S4 MolecularWeight: 995.34198

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1=CC=CC=C1)(C(=O)NC(C)(CSCC2=CC=CC=C2)C(=O)NC(C)(CSCC3=CC=CC=C3)C(=O)OC)NC(=O)C(C)(CSCC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5

Isomeric SMILES

C[C@](CSCC1=CC=CC=C1)(C(=O)N[C@](C)(CSCC2=CC=CC=C2)C(=O)N[C@@](C)(CSCC3=CC=CC=C3)C(=O)OC)NC(=O)[C@@](C)(CSCC4=CC=CC=C4)NC(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C53H62N4O7S4/c1-50(36-65-32-41-23-13-7-14-24-41,55-47(60)52(3,38-67-34-43-27-17-9-18-28-43)57-49(62)64-31-40-21-11-6-12-22-40)45(58)54-51(2,37-66-33-42-25-15-8-16-26-42)46(59)56-53(4,48(61)63-5)39-68-35-44-29-19-10-20-30-44/h6-30H,31-39H2,1-5H3,(H,54,58)(H,55,60)(H,56,59)(H,57,62)/t50-,51+,52+,53-/m0/s1