2-azanylbutanedioic acid; 2-azanyl-4-oxidanyl-4-oxidanylidene-butanoate; 2-azanylpentanedioic acid

Systemtic Name: 2-azanylbutanedioic acid; 2-azanyl-4-oxidanyl-4-oxidanylidene-butanoate; 2-azanylpentanedioic acid Openeye Name: 2-aminobutanedioic acid; 2-amino-4-hydroxy-4-oxo-butanoate; 2-aminopentanedioic acid CAS Name: 2-aminobutanedioic acid; 2-amino-4-hydroxy-4-oxobutanoate; 2-aminopentanedioic acid IUPAC Name: 2-aminobutanedioic acid; 2-amino-4-hydroxy-4-oxobutanoate; 2-aminopentanedioic acid Traditional Name: 2-aminoglutaric acid; 2-amino-4-hydroxy-4-keto-butyrate; 2-aminosuccinic acid Formula: C21H36N5O20- MolecularWeight: 678.53204

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)C(C(=O)O)N.C(C(C(=O)O)N)C(=O)O.C(C(C(=O)O)N)C(=O)O.C(C(C(=O)O)N)C(=O)O.C(C(C(=O)[O-])N)C(=O)O

Isomeric SMILES

C(CC(=O)O)C(C(=O)O)N.C(C(C(=O)O)N)C(=O)O.C(C(C(=O)O)N)C(=O)O.C(C(C(=O)O)N)C(=O)O.C(C(C(=O)[O-])N)C(=O)O

InChI

InChI=1S/C5H9NO4.4C4H7NO4/c6-3(5(9)10)1-2-4(7)8;4*5-2(4(8)9)1-3(6)7/h3H,1-2,6H2,(H,7,8)(H,9,10);4*2H,1,5H2,(H,6,7)(H,8,9)/p-1