tetrapotassium [2,3-dimethoxy-5-(3-methylbut-2-enyl)-4-phosphonatooxy-phenyl] phosphate

Systemtic Name: tetrapotassium [2,3-dimethoxy-5-(3-methylbut-2-enyl)-4-phosphonatooxy-phenyl] phosphate Openeye Name: tetrapotassium [2,3-dimethoxy-5-(3-methylbut-2-enyl)-4-phosphonatooxy-phenyl] phosphate CAS Name: tetrapotassium [2,3-dimethoxy-5-(3-methylbut-2-enyl)-4-phosphonatooxyphenyl] phosphate IUPAC Name: tetrapotassium [2,3-dimethoxy-5-(3-methylbut-2-enyl)-4-phosphonatooxyphenyl] phosphate Traditional Name: tetrapotassium [2,3-dimethoxy-5-(3-methylbut-2-enyl)-4-phosphato-phenyl] phosphate Formula: C13H16K4O10P2 MolecularWeight: 550.600862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=CC(=C(C(=C1OP(=O)([O-])[O-])OC)OC)OP(=O)([O-])[O-])C.[K+].[K+].[K+].[K+]

Isomeric SMILES

CC(=CCC1=CC(=C(C(=C1OP(=O)([O-])[O-])OC)OC)OP(=O)([O-])[O-])C.[K+].[K+].[K+].[K+]

InChI

InChI=1S/C13H20O10P2.4K/c1-8(2)5-6-9-7-10(22-24(14,15)16)12(20-3)13(21-4)11(9)23-25(17,18)19;;;;/h5,7H,6H2,1-4H3,(H2,14,15,16)(H2,17,18,19);;;;/q;4*+1/p-4