4-azanyl-2-[[6-azanyl-2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[[6-azanyl-2-[[2-azanyl-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[6-amino-2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[6-amino-2-[[2-amino-3-(4-hydroxyphenyl)-1-oxopropyl]amino]-1-oxohexyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[6-amino-2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[6-amino-2-(tyrosylamino)hexanoyl]amino]-4-keto-butyric acid Formula: C19H29N5O6 MolecularWeight: 423.46346

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)NC(CCCCN)C(=O)NC(CC(=O)N)C(=O)O)N)O

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)NC(CCCCN)C(=O)NC(CC(=O)N)C(=O)O)N)O

InChI

InChI=1S/C19H29N5O6/c20-8-2-1-3-14(18(28)24-15(19(29)30)10-16(22)26)23-17(27)13(21)9-11-4-6-12(25)7-5-11/h4-7,13-15,25H,1-3,8-10,20-21H2,(H2,22,26)(H,23,27)(H,24,28)(H,29,30)