[(1S)-2,5-bis(oxidanyl)-3,4,6-triphosphonatooxy-cyclohexyl] phosphate

Systemtic Name: [(1S)-2,5-bis(oxidanyl)-3,4,6-triphosphonatooxy-cyclohexyl] phosphate Openeye Name: [(1S)-2,5-dihydroxy-3,4,6-triphosphonatooxy-cyclohexyl] phosphate CAS Name: [(1S)-2,5-dihydroxy-3,4,6-triphosphonatooxycyclohexyl] phosphate IUPAC Name: [(1S)-2,5-dihydroxy-3,4,6-triphosphonatooxycyclohexyl] phosphate Traditional Name: [(1S)-2,5-dihydroxy-3,4,6-triphosphato-cyclohexyl] phosphate Formula: C6H8O18P4-8 MolecularWeight: 492.011964

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Descriptors Computed from Structure

Canonical SMILES:

C1(C(C(C(C(C1OP(=O)([O-])[O-])OP(=O)([O-])[O-])O)OP(=O)([O-])[O-])OP(=O)([O-])[O-])O

Isomeric SMILES

[C@@H]1(C(C(C(C(C1OP(=O)([O-])[O-])O)OP(=O)([O-])[O-])OP(=O)([O-])[O-])O)OP(=O)([O-])[O-]

InChI

InChI=1S/C6H16O18P4/c7-1-3(21-25(9,10)11)5(23-27(15,16)17)2(8)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)/p-8/t1?,2?,3-,4?,5?,6?/m0/s1