azane; [2,3-bis(oxidanyl)-4,5,6-triphosphonooxy-cyclohexyl] dihydrogen phosphate

Systemtic Name: azane; [2,3-bis(oxidanyl)-4,5,6-triphosphonooxy-cyclohexyl] dihydrogen phosphate Openeye Name: ammonia; (2,3-dihydroxy-4,5,6-triphosphonooxy-cyclohexyl) dihydrogen phosphate CAS Name: ammonia; (2,3-dihydroxy-4,5,6-triphosphonooxycyclohexyl) dihydrogen phosphate IUPAC Name: azane; (2,3-dihydroxy-4,5,6-triphosphonooxycyclohexyl) dihydrogen phosphate Traditional Name: ammonia; (2,3-dihydroxy-4,5,6-triphosphonooxy-cyclohexyl) dihydrogen phosphate Formula: C6H19NO18P4 MolecularWeight: 517.106004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H16O18P4.H3N/c7-1-2(8)4(22-26(12,13)14)6(24-28(18,19)20)5(23-27(15,16)17)3(1)21-25(9,10)11;/h1-8H,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20);1H3