Chemical Component Summary

Name(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-1-NONYLPIPERIDINE-3,4,5-TRIOL
SynonymsN-NONYL-DEOXYNOJIRIMYCIN
Identifiers(1R,2R,3R,4R,5S)-2-(hydroxymethyl)-1-nonyl-piperidine-3,4,5-triol
FormulaC15 H31 N O4
Molecular Weight289.411
TypeNON-POLYMER
Isomeric SMILESCCCCCCCCC[N@@]1C[C@@H]([C@H]([C@@H]([C@H]1CO)O)O)O
InChIInChI=1S/C15H31NO4/c1-2-3-4-5-6-7-8-9-16-10-13(18)15(20)14(19)12(16)11-17/h12-15,17-20H,2-11H2,1H3/t12-,13+,14-,15-/m1/s1
InChIKeyFTSCEGKYKXESFF-LXTVHRRPSA-N

Chemical Details

Formal Charge0
Atom Count51
Chiral Atom Count4
Bond Count51
Aromatic Bond Count0

Drug Info: DrugBank

DrugBank IDDB08283 
Name(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-1-NONYLPIPERIDINE-3,4,5-TRIOL
Groups experimental
Synonyms(2R,3R,4R,5S)-2-(HYDROXYMETHYL)-1-NONYLPIPERIDINE-3,4,5-TRIOL

Drug Targets

NameTarget SequencePharmacological ActionActions
GlucosylceramidaseMEFSSPSREECPKPLSRVSIMAGSLTGLLLLQAVSWASGARPCIPKSFGY...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
Pharos CHEMBL408500
PubChem 501640
ChEMBL CHEMBL408500
ChEBI CHEBI:76399