2-azanyl-5-oxidanylidene-5-phosphonoperoxy-pentanoic acid; carbonic acid; ethanoic acid; propane-1,2,3-tricarboxylic acid

Systemtic Name: 2-azanyl-5-oxidanylidene-5-phosphonoperoxy-pentanoic acid; carbonic acid; ethanoic acid; propane-1,2,3-tricarboxylic acid Openeye Name: acetic acid; 2-amino-5-oxo-5-phosphonoperoxy-pentanoic acid; carbonic acid; propane-1,2,3-tricarboxylic acid CAS Name: acetic acid; 2-amino-5-oxo-5-phosphonodioxypentanoic acid; carbonic acid; propane-1,2,3-tricarboxylic acid IUPAC Name: acetic acid; 2-amino-5-oxo-5-phosphonoperoxypentanoic acid; carbonic acid; propane-1,2,3-tricarboxylic acid Traditional Name: acetic acid; 2-amino-5-keto-5-phosphonoperoxy-valeric acid; carbonic acid; propane-1,2,3-tricarboxylic acid Formula: C14H24NO19P MolecularWeight: 541.309421

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C(CC(=O)OOP(=O)(O)O)C(C(=O)O)N.C(C(CC(=O)O)C(=O)O)C(=O)O.C(=O)(O)O

Isomeric SMILES

CC(=O)O.C(CC(=O)OOP(=O)(O)O)C(C(=O)O)N.C(C(CC(=O)O)C(=O)O)C(=O)O.C(=O)(O)O

InChI

InChI=1S/C6H8O6.C5H10NO8P.C2H4O2.CH2O3/c7-4(8)1-3(6(11)12)2-5(9)10;6-3(5(8)9)1-2-4(7)13-14-15(10,11)12;1-2(3)4;2-1(3)4/h3H,1-2H2,(H,7,8)(H,9,10)(H,11,12);3H,1-2,6H2,(H,8,9)(H2,10,11,12);1H3,(H,3,4);(H2,2,3,4)