potassium [2,6-bis(oxidanyl)-3,4,5-triphosphonooxy-cyclohexyl] hydrogen phosphate

Systemtic Name: potassium [2,6-bis(oxidanyl)-3,4,5-triphosphonooxy-cyclohexyl] hydrogen phosphate Openeye Name: potassium (2,6-dihydroxy-3,4,5-triphosphonooxy-cyclohexyl) hydrogen phosphate CAS Name: potassium (2,6-dihydroxy-3,4,5-triphosphonooxycyclohexyl) hydrogen phosphate IUPAC Name: potassium (2,6-dihydroxy-3,4,5-triphosphonooxycyclohexyl) hydrogen phosphate Traditional Name: potassium (2,6-dihydroxy-3,4,5-triphosphonooxy-cyclohexyl) hydrogen phosphate Formula: C6H15KO18P4 MolecularWeight: 538.165844

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Descriptors Computed from Structure

Canonical SMILES:

C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)O)OP(=O)(O)[O-])O.[K+]

Isomeric SMILES

C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O)O)OP(=O)(O)[O-])O.[K+]

InChI

InChI=1S/C6H16O18P4.K/c7-1-3(21-25(9,10)11)2(8)5(23-27(15,16)17)6(24-28(18,19)20)4(1)22-26(12,13)14;/h1-8H,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20);/q;+1/p-1