[2-azanyl-3,5-bis(oxidanyl)-4,6-diphosphonooxy-cyclohexyl] dihydrogen phosphate

Systemtic Name: [2-azanyl-3,5-bis(oxidanyl)-4,6-diphosphonooxy-cyclohexyl] dihydrogen phosphate Openeye Name: (2-amino-3,5-dihydroxy-4,6-diphosphonooxy-cyclohexyl) dihydrogen phosphate CAS Name: (2-amino-3,5-dihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate IUPAC Name: (2-amino-3,5-dihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate Traditional Name: (2-amino-3,5-dihydroxy-4,6-diphosphonooxy-cyclohexyl) dihydrogen phosphate Formula: C6H16NO14P3 MolecularWeight: 419.110823

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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)O)N

Isomeric SMILES

C1(C(C(C(C(C1OP(=O)(O)O)OP(=O)(O)O)O)OP(=O)(O)O)O)N

InChI

InChI=1S/C6H16NO14P3/c7-1-2(8)5(20-23(13,14)15)3(9)6(21-24(16,17)18)4(1)19-22(10,11)12/h1-6,8-9H,7H2,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)