4-azanyl-2-[[2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-oxidanyl-butanoyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[[2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]-3-oxidanyl-butanoyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxy-butanoyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-3-hydroxy-1-oxobutyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[3-hydroxy-2-(tyrosylamino)butanoyl]amino]-4-keto-butyric acid Formula: C17H24N4O7 MolecularWeight: 396.39506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N4O7/c1-8(22)14(16(26)20-12(17(27)28)7-13(19)24)21-15(25)11(18)6-9-2-4-10(23)5-3-9/h2-5,8,11-12,14,22-23H,6-7,18H2,1H3,(H2,19,24)(H,20,26)(H,21,25)(H,27,28)