calcium [1,3-bis(oxidanyl)propan-2-yloxy-oxidanidyl-phosphoryl] phosphate

Systemtic Name: calcium [1,3-bis(oxidanyl)propan-2-yloxy-oxidanidyl-phosphoryl] phosphate Openeye Name: calcium [[2-hydroxy-1-(hydroxymethyl)ethoxy]-oxido-phosphoryl] phosphate CAS Name: calcium [1,3-dihydroxypropan-2-yloxy(oxido)phosphoryl] phosphate IUPAC Name: calcium [1,3-dihydroxypropan-2-yloxy(oxido)phosphoryl] phosphate Traditional Name: calcium [(2-hydroxy-1-methylol-ethoxy)-oxido-phosphoryl] phosphate Formula: C3H7CaO9P2- MolecularWeight: 289.107802

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CO)OP(=O)([O-])OP(=O)([O-])[O-])O.[Ca+2]

Isomeric SMILES

C(C(CO)OP(=O)([O-])OP(=O)([O-])[O-])O.[Ca+2]

InChI

InChI=1S/C3H10O9P2.Ca/c4-1-3(2-5)11-14(9,10)12-13(6,7)8;/h3-5H,1-2H2,(H,9,10)(H2,6,7,8);/q;+2/p-3