1,3-bis(oxidanyl)nonadecane-2,4-dione phosphate

Systemtic Name: 1,3-bis(oxidanyl)nonadecane-2,4-dione phosphate Openeye Name: 1,3-dihydroxynonadecane-2,4-dione phosphate CAS Name: 1,3-dihydroxynonadecane-2,4-dione phosphate IUPAC Name: 1,3-dihydroxynonadecane-2,4-dione phosphate Traditional Name: 1,3-dihydroxynonadecane-2,4-dione phosphate Formula: C19H36O8P-3 MolecularWeight: 423.458101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(=O)CO)O.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(=O)CO)O.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C19H36O4.H3O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(21)19(23)18(22)16-20;1-5(2,3)4/h19-20,23H,2-16H2,1H3;(H3,1,2,3,4)/p-3