Chemical Component Summary

Namehydrogen [(1S)-2-(3-decyl-1H-imidazol-3-ium-1-yl)-1-phosphonoethyl]phosphonate
Identifiers[2-(3-decylimidazol-3-ium-1-yl)-1-phosphono-ethyl]-oxidanyl-phosphinate
FormulaC15 H30 N2 O6 P2
Molecular Weight396.356
TypeNON-POLYMER
Isomeric SMILESCCCCCCCCCC[n+]1ccn(c1)CC(P(=O)(O)O)P(=O)(O)[O-]
InChIInChI=1S/C15H30N2O6P2/c1-2-3-4-5-6-7-8-9-10-16-11-12-17(14-16)13-15(24(18,19)20)25(21,22)23/h11-12,14-15H,2-10,13H2,1H3,(H3-,18,19,20,21,22,23)
InChIKeyGYTSEUQBLYSXFG-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count55
Chiral Atom Count1
Bond Count55
Aromatic Bond Count5

Related Resource References

Resource NameReference
Pharos CHEMBL2338378
PubChem 137349009, 71624313
ChEMBL CHEMBL2338378