(3,5-diphosphonooxycyclohexyl) dihydrogen phosphate

Systemtic Name: (3,5-diphosphonooxycyclohexyl) dihydrogen phosphate Openeye Name: (3,5-diphosphonooxycyclohexyl) dihydrogen phosphate CAS Name: (3,5-diphosphonooxycyclohexyl) dihydrogen phosphate IUPAC Name: (3,5-diphosphonooxycyclohexyl) dihydrogen phosphate Traditional Name: (3,5-diphosphonooxycyclohexyl) dihydrogen phosphate Formula: C6H15O12P3 MolecularWeight: 372.097383

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(CC1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O

Isomeric SMILES

C1C(CC(CC1OP(=O)(O)O)OP(=O)(O)O)OP(=O)(O)O

InChI

InChI=1S/C6H15O12P3/c7-19(8,9)16-4-1-5(17-20(10,11)12)3-6(2-4)18-21(13,14)15/h4-6H,1-3H2,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)