(2-oxidanyl-3,4,5-triphosphonooxy-cyclohexyl) dihydrogen phosphate

Systemtic Name: (2-oxidanyl-3,4,5-triphosphonooxy-cyclohexyl) dihydrogen phosphate Openeye Name: (2-hydroxy-3,4,5-triphosphonooxy-cyclohexyl) dihydrogen phosphate CAS Name: (2-hydroxy-3,4,5-triphosphonooxycyclohexyl) dihydrogen phosphate IUPAC Name: (2-hydroxy-3,4,5-triphosphonooxycyclohexyl) dihydrogen phosphate Traditional Name: (2-hydroxy-3,4,5-triphosphonooxy-cyclohexyl) dihydrogen phosphate Formula: C6H16O17P4 MolecularWeight: 484.076084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H16O17P4/c7-4-2(20-24(8,9)10)1-3(21-25(11,12)13)5(22-26(14,15)16)6(4)23-27(17,18)19/h2-7H,1H2,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)