[1,2,3-tris(oxidanyl)-2,4-diphosphonooxy-cyclohexyl] dihydrogen phosphate

Systemtic Name: [1,2,3-tris(oxidanyl)-2,4-diphosphonooxy-cyclohexyl] dihydrogen phosphate Openeye Name: (1,2,3-trihydroxy-2,4-diphosphonooxy-cyclohexyl) dihydrogen phosphate CAS Name: (1,2,3-trihydroxy-2,4-diphosphonooxycyclohexyl) dihydrogen phosphate IUPAC Name: (1,2,3-trihydroxy-2,4-diphosphonooxycyclohexyl) dihydrogen phosphate Traditional Name: (1,2,3-trihydroxy-2,4-diphosphonooxy-cyclohexyl) dihydrogen phosphate Formula: C6H15O15P3 MolecularWeight: 420.095583

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C(C1OP(=O)(O)O)O)(O)OP(=O)(O)O)(O)OP(=O)(O)O

Isomeric SMILES

C1CC(C(C(C1OP(=O)(O)O)O)(O)OP(=O)(O)O)(O)OP(=O)(O)O

InChI

InChI=1S/C6H15O15P3/c7-4-3(19-22(10,11)12)1-2-5(8,20-23(13,14)15)6(4,9)21-24(16,17)18/h3-4,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)