WUR

(2R,3R,4R,5S)-2-(hydroxymethyl)-1-{6-[2-methyl-5-(pyrimidin-2-yl)-1H-benzimidazol-1-yl]hexyl}piperidine-3,4,5-triol



Chemical Component Summary

Name(2R,3R,4R,5S)-2-(hydroxymethyl)-1-{6-[2-methyl-5-(pyrimidin-2-yl)-1H-benzimidazol-1-yl]hexyl}piperidine-3,4,5-triol
Identifiers(2~{R},3~{R},4~{R},5~{S})-2-(hydroxymethyl)-1-[6-(2-methyl-5-pyrimidin-2-yl-benzimidazol-1-yl)hexyl]piperidine-3,4,5-triol
FormulaC24 H33 N5 O4
Molecular Weight455.55
TypeNON-POLYMER
Isomeric SMILESCc1nc2cc(ccc2n1CCCCCCN3C[C@@H]([C@H]([C@@H]([C@H]3CO)O)O)O)c4ncccn4
InChIInChI=1S/C24H33N5O4/c1-16-27-18-13-17(24-25-9-6-10-26-24)7-8-19(18)29(16)12-5-3-2-4-11-28-14-21(31)23(33)22(32)20(28)15-30/h6-10,13,20-23,30-33H,2-5,11-12,14-15H2,1H3/t20-,21+,22-,23-/m1/s1
InChIKeyXPRZPIFSIBBCSM-KAOXLYBCSA-N

Chemical Details

Formal Charge0
Atom Count66
Chiral Atom Count4
Bond Count69
Aromatic Bond Count16

Related Resource References

Resource NameReference
PubChem 166625088