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

Systemtic Name: 4-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-5-[(3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-[(1-carboxy-2-methyl-propyl)amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-5-[(1-hydroxy-3-methyl-1-oxobutan-2-yl)amino]-5-oxopentanoic acid IUPAC Name: 4-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-5-[(1-hydroxy-3-methyl-1-oxobutan-2-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(1-carboxy-2-methyl-propyl)amino]-5-keto-4-(tyrosylamino)valeric acid Formula: C19H27N3O7 MolecularWeight: 409.43358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27N3O7/c1-10(2)16(19(28)29)22-18(27)14(7-8-15(24)25)21-17(26)13(20)9-11-3-5-12(23)6-4-11/h3-6,10,13-14,16,23H,7-9,20H2,1-2H3,(H,21,26)(H,22,27)(H,24,25)(H,28,29)