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

Systemtic Name: 4-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-5-oxidanylidene-5-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]pentanoic acid Openeye Name: 4-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-[(2-hydroxy-1-methyl-2-oxo-ethyl)amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-5-[(1-hydroxy-1-oxopropan-2-yl)amino]-5-oxopentanoic acid IUPAC Name: 4-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-[(1-hydroxy-1-oxopropan-2-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(2-hydroxy-2-keto-1-methyl-ethyl)amino]-5-keto-4-(tyrosylamino)valeric acid Formula: C17H23N3O7 MolecularWeight: 381.38042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC1=CC=C(C=C1)O)N

Isomeric SMILES

CC(C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC1=CC=C(C=C1)O)N

InChI

InChI=1S/C17H23N3O7/c1-9(17(26)27)19-16(25)13(6-7-14(22)23)20-15(24)12(18)8-10-2-4-11(21)5-3-10/h2-5,9,12-13,21H,6-8,18H2,1H3,(H,19,25)(H,20,24)(H,22,23)(H,26,27)