[(1S,5R,6S)-5,6-bis(oxidanyl)-3-phosphonato-cyclohex-3-en-1-yl] phosphate

Systemtic Name: [(1S,5R,6S)-5,6-bis(oxidanyl)-3-phosphonato-cyclohex-3-en-1-yl] phosphate Openeye Name: [(1S,5R,6S)-5,6-dihydroxy-3-phosphonato-cyclohex-3-en-1-yl] phosphate CAS Name: [(1S,5R,6S)-5,6-dihydroxy-3-phosphonato-1-cyclohex-3-enyl] phosphate IUPAC Name: [(1S,5R,6S)-5,6-dihydroxy-3-phosphonatocyclohex-3-en-1-yl] phosphate Traditional Name: [(1S,5R,6S)-5,6-dihydroxy-3-phosphonato-cyclohex-3-en-1-yl] phosphate Formula: C6H8O9P2-4 MolecularWeight: 286.069842

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(C=C1P(=O)([O-])[O-])O)O)OP(=O)([O-])[O-]

Isomeric SMILES

C1[C@@H]([C@H]([C@@H](C=C1P(=O)([O-])[O-])O)O)OP(=O)([O-])[O-]

InChI

InChI=1S/C6H12O9P2/c7-4-1-3(16(9,10)11)2-5(6(4)8)15-17(12,13)14/h1,4-8H,2H2,(H2,9,10,11)(H2,12,13,14)/p-4/t4-,5+,6+/m1/s1