4-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxidanylidene-5-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]pentanoic acid

Systemtic Name: 4-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxidanylidene-5-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]pentanoic acid Openeye Name: 4-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-[(1-benzyl-2-hydroxy-2-oxo-ethyl)amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-5-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-5-oxopentanoic acid IUPAC Name: 4-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(1-benzyl-2-hydroxy-2-keto-ethyl)amino]-5-keto-4-(tyrosylamino)valeric acid Formula: C23H27N3O7 MolecularWeight: 457.47638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O7/c24-17(12-15-6-8-16(27)9-7-15)21(30)25-18(10-11-20(28)29)22(31)26-19(23(32)33)13-14-4-2-1-3-5-14/h1-9,17-19,27H,10-13,24H2,(H,25,30)(H,26,31)(H,28,29)(H,32,33)