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CHEBI:5369 - glabridin

ChEBI IDCHEBI:5369
ChEBI Nameglabridin
Stars
DefinitionA member of the class of hydroxyisoflavans that is (R)-isoflavan substituted by hydroxy groups at positions 2' and 4' and a 2,2-dimethyl-2H-pyran group across positions 7 and 8 respectively.
Last Modified6 July 2015
DownloadsMolfile
FormulaC20H20O4
Net Charge0
Average Mass324.376
Monoisotopic Mass324.13616
SMILESCC1(C)C=Cc2c(ccc3c2OC[C@@H](c2ccc(O)cc2O)C3)O1
InChIInChI=1S/C20H20O4/c1-20(2)8-7-16-18(24-20)6-3-12-9-13(11-23-19(12)16)15-5-4-14(21)10-17(15)22/h3-8,10,13,21-22H,9,11H2,1-2H3/t13-/m0/s1
InChIKeyLBQIJVLKGVZRIW-ZDUSSCGKSA-N
Wikipedia
Roles Classification
Biological Role:
antiplasmodial drug  An antiparasitic drug which is effective against Apicomplexan parasites in the genus Plasmodium. The genus contains over 200 species and includes those responsible for malaria.
Application:
antiplasmodial drug  An antiparasitic drug which is effective against Apicomplexan parasites in the genus Plasmodium. The genus contains over 200 species and includes those responsible for malaria.
ChEBI Ontology
Outgoing Relation(s)
glabridin (CHEBI:5369) has parent hydride (R)-isoflavan (CHEBI:36101)
glabridin (CHEBI:5369) has role antiplasmodial drug (CHEBI:64915)
glabridin (CHEBI:5369) is a hydroxyisoflavans (CHEBI:76250)
IUPAC Name 
4-[(3R)-8,8-dimethyl-3,4-dihydro-2H,8H-benzo[1,2-b:3,4-b']dipyran-3-yl]benzene-1,3-diol
Manual XrefsDatabases
C00002529KNApSAcK
C10421KEGG COMPOUND
GlabridinWikipedia
HMDB0034188HMDB
LMPK12080012LIPID MAPS
Registry NumbersSources
Reaxys:7141956Reaxys
CAS:59870-68-7KEGG COMPOUND
CAS:59870-68-7ChemIDplus
Citations