2,3-bis(azanyl)-3-(2-azanyl-4-methyl-pentanoyl)-2-oxidanyl-4-(4-phenylbutanoyl)pentanedioic acid

Systemtic Name: 2,3-bis(azanyl)-3-(2-azanyl-4-methyl-pentanoyl)-2-oxidanyl-4-(4-phenylbutanoyl)pentanedioic acid Openeye Name: 2,3-diamino-3-(2-amino-4-methyl-pentanoyl)-2-hydroxy-4-(4-phenylbutanoyl)pentanedioic acid CAS Name: 2,3-diamino-3-(2-amino-4-methyl-1-oxopentyl)-2-hydroxy-4-(1-oxo-4-phenylbutyl)pentanedioic acid IUPAC Name: 2,3-diamino-3-(2-amino-4-methylpentanoyl)-2-hydroxy-4-(4-phenylbutanoyl)pentanedioic acid Traditional Name: 2,3-diamino-3-(2-amino-4-methyl-pentanoyl)-2-hydroxy-4-(4-phenylbutanoyl)glutaric acid Formula: C21H31N3O7 MolecularWeight: 437.48674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)C(C(C(=O)CCCC1=CC=CC=C1)C(=O)O)(C(C(=O)O)(N)O)N)N

Isomeric SMILES

CC(C)CC(C(=O)C(C(C(=O)CCCC1=CC=CC=C1)C(=O)O)(C(C(=O)O)(N)O)N)N

InChI

InChI=1S/C21H31N3O7/c1-12(2)11-14(22)17(26)20(23,21(24,31)19(29)30)16(18(27)28)15(25)10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12,14,16,31H,6,9-11,22-24H2,1-2H3,(H,27,28)(H,29,30)