methyl-[2,4,5-tris(oxidanyl)-3,6-diphosphonooxy-cyclohexyl]oxy-phosphinic acid

Systemtic Name: methyl-[2,4,5-tris(oxidanyl)-3,6-diphosphonooxy-cyclohexyl]oxy-phosphinic acid Openeye Name: methyl-(2,4,5-trihydroxy-3,6-diphosphonooxy-cyclohexoxy)phosphinic acid CAS Name: methyl-(2,4,5-trihydroxy-3,6-diphosphonooxycyclohexyl)oxyphosphinic acid IUPAC Name: methyl-(2,4,5-trihydroxy-3,6-diphosphonooxycyclohexyl)oxyphosphinic acid Traditional Name: methyl-(2,4,5-trihydroxy-3,6-diphosphonooxy-cyclohexoxy)phosphinic acid Formula: C7H17O14P3 MolecularWeight: 418.122763

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Descriptors Computed from Structure

Canonical SMILES:

CP(=O)(O)OC1C(C(C(C(C1OP(=O)(O)O)O)O)OP(=O)(O)O)O

Isomeric SMILES

CP(=O)(O)OC1C(C(C(C(C1OP(=O)(O)O)O)O)OP(=O)(O)O)O

InChI

InChI=1S/C7H17O14P3/c1-22(11,12)19-7-4(10)5(20-23(13,14)15)2(8)3(9)6(7)21-24(16,17)18/h2-10H,1H3,(H,11,12)(H2,13,14,15)(H2,16,17,18)