UQH

(2R,3R,4R,5S)-1-(6-{[(5M)-3-cyclopropyl-5-(pyridazin-3-yl)phenyl]amino}hexyl)-2-(hydroxymethyl)piperidine-3,4,5-triol



Chemical Component Summary

Name(2R,3R,4R,5S)-1-(6-{[(5M)-3-cyclopropyl-5-(pyridazin-3-yl)phenyl]amino}hexyl)-2-(hydroxymethyl)piperidine-3,4,5-triol
Identifiers(2~{R},3~{R},4~{R},5~{S})-1-[6-[(3-cyclopropyl-5-pyridazin-3-yl-phenyl)amino]hexyl]-2-(hydroxymethyl)piperidine-3,4,5-triol
FormulaC25 H36 N4 O4
Molecular Weight456.578
TypeNON-POLYMER
Isomeric SMILESc1cc(nnc1)c2cc(cc(c2)NCCCCCCN3C[C@@H]([C@H]([C@@H]([C@H]3CO)O)O)O)C4CC4
InChIInChI=1S/C25H36N4O4/c30-16-22-24(32)25(33)23(31)15-29(22)11-4-2-1-3-9-26-20-13-18(17-7-8-17)12-19(14-20)21-6-5-10-27-28-21/h5-6,10,12-14,17,22-26,30-33H,1-4,7-9,11,15-16H2/t22-,23+,24-,25-/m1/s1
InChIKeyLSJOTQOBANSWBZ-ZFFYZDHPSA-N

Chemical Details

Formal Charge0
Atom Count69
Chiral Atom Count4
Bond Count72
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 162439333