(3R)-4-[[(2R)-1-[[(2R)-1-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]oxyamino]-1-oxidanylidene-3-phenyl-propan-2-yl]oxyamino]-4-methyl-1-oxidanylidene-pentan-2-yl]oxyamino]-3-[[(2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]oxy-3-phenyl-propanoyl]amino]oxy-4-oxidanylidene-butanoic acid

Systemtic Name: (3R)-4-[[(2R)-1-[[(2R)-1-[[(2R)-1-azanyl-1-oxidanylidene-propan-2-yl]oxyamino]-1-oxidanylidene-3-phenyl-propan-2-yl]oxyamino]-4-methyl-1-oxidanylidene-pentan-2-yl]oxyamino]-3-[[(2R)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]oxy-3-phenyl-propanoyl]amino]oxy-4-oxidanylidene-butanoic acid Openeye Name: (3R)-4-[[(1R)-1-[[(1R)-2-[[(1R)-2-amino-1-methyl-2-oxo-ethoxy]amino]-1-benzyl-2-oxo-ethoxy]carbamoyl]-3-methyl-butoxy]amino]-3-[[(2R)-2-(1,3-dioxoisoindolin-2-yl)oxy-3-phenyl-propanoyl]amino]oxy-4-oxo-butanoic acid CAS Name: (3R)-4-[[(2R)-1-[[(2R)-1-[[(2R)-1-amino-1-oxopropan-2-yl]oxyamino]-1-oxo-3-phenylpropan-2-yl]oxyamino]-4-methyl-1-oxopentan-2-yl]oxyamino]-3-[[(2R)-2-[(1,3-dioxo-2-isoindolyl)oxy]-1-oxo-3-phenylpropyl]amino]oxy-4-oxobutanoic acid IUPAC Name: (3R)-4-[[(2R)-1-[[(2R)-1-[[(2R)-1-amino-1-oxopropan-2-yl]oxyamino]-1-oxo-3-phenylpropan-2-yl]oxyamino]-4-methyl-1-oxopentan-2-yl]oxyamino]-3-[[(2R)-2-(1,3-dioxoisoindol-2-yl)oxy-3-phenylpropanoyl]amino]oxy-4-oxobutanoic acid Traditional Name: (3R)-4-[[(1R)-1-[[(1R)-2-[[(1R)-2-amino-2-keto-1-methyl-ethoxy]amino]-1-benzyl-2-keto-ethoxy]carbamoyl]-3-methyl-butoxy]amino]-4-keto-3-[[(2R)-3-phenyl-2-phthalimidooxy-propanoyl]amino]oxy-butyric acid Formula: C39H44N6O14 MolecularWeight: 820.79846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NOC(CC1=CC=CC=C1)C(=O)NOC(C)C(=O)N)ONC(=O)C(CC(=O)O)ONC(=O)C(CC2=CC=CC=C2)ON3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C[C@H](C(=O)N)ONC(=O)[C@@H](CC1=CC=CC=C1)ONC(=O)[C@@H](CC(C)C)ONC(=O)[C@@H](CC(=O)O)ONC(=O)[C@@H](CC2=CC=CC=C2)ON3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C39H44N6O14/c1-22(2)18-28(34(49)42-57-29(19-24-12-6-4-7-13-24)35(50)41-55-23(3)33(40)48)56-43-36(51)30(21-32(46)47)58-44-37(52)31(20-25-14-8-5-9-15-25)59-45-38(53)26-16-10-11-17-27(26)39(45)54/h4-17,22-23,28-31H,18-21H2,1-3H3,(H2,40,48)(H,41,50)(H,42,49)(H,43,51)(H,44,52)(H,46,47)/t23-,28-,29-,30-,31-/m1/s1