4-azanyl-5-[[1-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-5-phenyl-pentanoyl]-phenyl-amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-azanyl-5-[[1-[[4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-5-phenyl-pentanoyl]-phenyl-amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[[2-(N-[4-(tert-butoxycarbonylamino)-3-hydroxy-5-phenyl-pentanoyl]anilino)-1-methyl-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[[1-(N-[3-hydroxy-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-5-phenylpentyl]anilino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[[1-(N-[3-hydroxy-4-[(2-methylpropan-2-yl)oxycarbonylamino]-5-phenylpentanoyl]anilino)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-amino-5-[[2-(N-[4-(tert-butoxycarbonylamino)-3-hydroxy-5-phenyl-pentanoyl]anilino)-2-keto-1-methyl-ethyl]amino]-5-keto-valeric acid Formula: C30H40N4O8 MolecularWeight: 584.6606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=CC=CC=C1)C(=O)CC(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CC(C(=O)N(C1=CC=CC=C1)C(=O)CC(C(CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O)NC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C30H40N4O8/c1-19(32-27(39)22(31)15-16-26(37)38)28(40)34(21-13-9-6-10-14-21)25(36)18-24(35)23(17-20-11-7-5-8-12-20)33-29(41)42-30(2,3)4/h5-14,19,22-24,35H,15-18,31H2,1-4H3,(H,32,39)(H,33,41)(H,37,38)