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CHEBI:44369 - duvoglustat

Default Structure
ChEBI IDCHEBI:44369
ChEBI Nameduvoglustat
Stars
DefinitionAn optically active form of 2-(hydroxymethyl)piperidine-3,4,5-triol having 2R,3R,4R,5S-configuration.
Secondary ChEBI IDsCHEBI:76525, CHEBI:132398, CHEBI:132867
Last Modified13 April 2021
Submitterliuqingping, Steve
DownloadsMolfile
FormulaC6H13NO4
Net Charge0
Average Mass163.173
Monoisotopic Mass163.08446
SMILESOC[C@H]1NC[C@H](O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C6H13NO4/c8-2-3-5(10)6(11)4(9)1-7-3/h3-11H,1-2H2/t3-,4+,5-,6-/m1/s1
InChIKeyLXBIFEVIBLOUGU-JGWLITMVSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Bacillus amyloliquefaciens (ncbitaxon:1390) - PubMed (23265519)
Bacillus subtilis (ncbitaxon:1423) - PubMed (23265519)
Moraceae (ncbitaxon:3487) - PubMed (23909841)
Morus alba (ncbitaxon:3498) latex (BTO:0000710) PubMed (27294120)
Roles Classification
Biological Roles:
anti-obesity agent  Any substance which is used to reduce or control weight.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
anti-HIV agent  An antiviral agent that destroys or inhibits the replication of the human immunodeficiency virus.
EC 3.2.1.20 (alpha-glucosidase) inhibitor  An EC 3.2.1.* (glycosidase) inhibitor that interferes with the action of α-glucosidase (EC 3.2.1.20).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Applications:
hypoglycemic agent  A drug which lowers the blood glucose level.
hepatoprotective agent  Any compound that is able to prevent damage to the liver.
ChEBI Ontology
Outgoing Relation(s)
duvoglustat (CHEBI:44369) has role anti-HIV agent (CHEBI:64946)
duvoglustat (CHEBI:44369) has role anti-obesity agent (CHEBI:74518)
duvoglustat (CHEBI:44369) has role bacterial metabolite (CHEBI:76969)
duvoglustat (CHEBI:44369) has role EC 3.2.1.20 (α-glucosidase) inhibitor (CHEBI:67239)
duvoglustat (CHEBI:44369) has role hepatoprotective agent (CHEBI:62868)
duvoglustat (CHEBI:44369) has role hypoglycemic agent (CHEBI:35526)
duvoglustat (CHEBI:44369) has role plant metabolite (CHEBI:76924)
duvoglustat (CHEBI:44369) is a 2-(hydroxymethyl)piperidine-3,4,5-triol (CHEBI:72490)
duvoglustat (CHEBI:44369) is a piperidine alkaloid (CHEBI:26147)
Incoming Relation(s)
N-ethyl-1-deoxynojirimycin (CHEBI:167666) has functional parent duvoglustat (CHEBI:44369)
N-methyl-1-deoxynojirimycin (CHEBI:166564) has functional parent duvoglustat (CHEBI:44369)
N-nonyldeoxynojirimycin (CHEBI:76399) has functional parent duvoglustat (CHEBI:44369)
1-deoxynojirimycin-1-sulfonic acid (CHEBI:167649) has functional parent duvoglustat (CHEBI:44369)
4-O-α-D-glucopyranosylmoranoline (CHEBI:70736) has functional parent duvoglustat (CHEBI:44369)
miglustat (CHEBI:50381) has functional parent duvoglustat (CHEBI:44369)
IUPAC Name 
(2R,3R,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-triol
INN  Source
duvoglustatKEGG DRUG
Synonyms  Source
1,5-deoxy-1,5-imino-D-mannitolDrugBank
1,5-dideoxy-1,5-imino-D-glucitolDrugBank
1-DeoxymannojirimycinDrugBank
(+)-1-DeoxynojirimycinKNApSAcK
1-DeoxynojirimycinKEGG DRUG
1-DEOXYNOJIRIMYCINPDBeChem
Manual XrefsDatabases
1-DeoxynojirimycinWikipedia
1-DEOXYNOJIRIMYCINMetaCyc
C00029420KNApSAcK
C16843KEGG COMPOUND
D09605KEGG DRUG
DB03206DrugBank
HMDB0035359HMDB
NOJPDBeChem
Registry NumbersSources
Reaxys:1524395Reaxys
CAS:19130-96-2KEGG COMPOUND
CAS:19130-96-2ChemIDplus
Citations