1,3,4-triphosphonatooxybutan-2-yl phosphate

Systemtic Name: 1,3,4-triphosphonatooxybutan-2-yl phosphate Openeye Name: [2,3-diphosphonatooxy-1-(phosphonatooxymethyl)propyl] phosphate CAS Name: 1,3,4-triphosphonatooxybutan-2-yl phosphate IUPAC Name: 1,3,4-triphosphonatooxybutan-2-yl phosphate Traditional Name: [2,3-diphosphato-1-(phosphatomethyl)propyl] phosphate Formula: C4H6O16P4-8 MolecularWeight: 433.975884

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(COP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-]

Isomeric SMILES

C(C(C(COP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-])OP(=O)([O-])[O-]

InChI

InChI=1S/C4H14O16P4/c5-21(6,7)17-1-3(19-23(11,12)13)4(20-24(14,15)16)2-18-22(8,9)10/h3-4H,1-2H2,(H2,5,6,7)(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)/p-8