disodium phosphono [3,4,5,6-tetrakis(oxidanyl)-2-oxidanylidene-hexyl] hydrogen phosphate

Systemtic Name: disodium phosphono [3,4,5,6-tetrakis(oxidanyl)-2-oxidanylidene-hexyl] hydrogen phosphate Openeye Name: disodium phosphono (3,4,5,6-tetrahydroxy-2-oxo-hexyl) hydrogen phosphate CAS Name: disodium phosphono (3,4,5,6-tetrahydroxy-2-oxohexyl) hydrogen phosphate IUPAC Name: disodium phosphono (3,4,5,6-tetrahydroxy-2-oxohexyl) hydrogen phosphate Traditional Name: disodium phosphono (3,4,5,6-tetrahydroxy-2-keto-hexyl) hydrogen phosphate Formula: C6H12Na2O12P2 MolecularWeight: 384.079342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[CH-](C(C(C(C(=O)[CH-]OP(=O)(O)OP(=O)(O)O)O)O)O)O.[Na+].[Na+]

Isomeric SMILES

[CH-](C(C(C(C(=O)[CH-]OP(=O)(O)OP(=O)(O)O)O)O)O)O.[Na+].[Na+]

InChI

InChI=1S/C6H12O12P2.2Na/c7-1-3(8)5(10)6(11)4(9)2-17-20(15,16)18-19(12,13)14;;/h1-3,5-8,10-11H,(H,15,16)(H2,12,13,14);;/q-2;2*+1