[2,5-bis(oxidanyl)-3,4-diphosphonooxy-cyclohexyl] dihydrogen phosphate

Systemtic Name: [2,5-bis(oxidanyl)-3,4-diphosphonooxy-cyclohexyl] dihydrogen phosphate Openeye Name: (2,5-dihydroxy-3,4-diphosphonooxy-cyclohexyl) dihydrogen phosphate CAS Name: (2,5-dihydroxy-3,4-diphosphonooxycyclohexyl) dihydrogen phosphate IUPAC Name: (2,5-dihydroxy-3,4-diphosphonooxycyclohexyl) dihydrogen phosphate Traditional Name: (2,5-dihydroxy-3,4-diphosphonooxy-cyclohexyl) dihydrogen phosphate Formula: C6H15O14P3 MolecularWeight: 404.096183

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C(C1OP(=O)(O)O)O)OP(=O)(O)O)OP(=O)(O)O)O

Isomeric SMILES

C1C(C(C(C(C1OP(=O)(O)O)O)OP(=O)(O)O)OP(=O)(O)O)O

InChI

InChI=1S/C6H15O14P3/c7-2-1-3(18-21(9,10)11)4(8)6(20-23(15,16)17)5(2)19-22(12,13)14/h2-8H,1H2,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)