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CHEBI:69437 - orobol

ChEBI IDCHEBI:69437
ChEBI Nameorobol
Stars
DefinitionA member of the class of 7-hydroxyisoflavones which consists of isoflavone substituted by hydroxy groups at positions 5, 7, 3' and 4'. It has been isolated from the mycelia of Cordyceps sinensis.
Secondary ChEBI IDCHEBI:7786
Last Modified25 June 2015
DownloadsMolfile
FormulaC15H10O6
Net Charge0
Average Mass286.239
Monoisotopic Mass286.04774
SMILESO=c1c(-c2ccc(O)c(O)c2)coc2cc(O)cc(O)c12
InChIInChI=1S/C15H10O6/c16-8-4-12(19)14-13(5-8)21-6-9(15(14)20)7-1-2-10(17)11(18)3-7/h1-6,16-19H
InChIKeyIOYHCQBYQJQBSK-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Cordyceps sinensis (ncbitaxon:72228) mycelium (BTO:0001436) PubMed (21848266) Ethanolic extract of dried mycelia
Roles Classification
Chemical Role:
radical scavenger  A role played by a substance that can react readily with, and thereby eliminate, radicals.
Biological Roles:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Application:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
ChEBI Ontology
Outgoing Relation(s)
orobol (CHEBI:69437) has functional parent isoflavone (CHEBI:18220)
orobol (CHEBI:69437) has role anti-inflammatory agent (CHEBI:67079)
orobol (CHEBI:69437) has role fungal metabolite (CHEBI:76946)
orobol (CHEBI:69437) has role plant metabolite (CHEBI:76924)
orobol (CHEBI:69437) has role radical scavenger (CHEBI:48578)
orobol (CHEBI:69437) is a 7-hydroxyisoflavones (CHEBI:55465)
Incoming Relation(s)
3'-O-methylorobol (CHEBI:70032) has functional parent orobol (CHEBI:69437)
IUPAC Name 
3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one
Synonyms  Source
3',4',5,7-tetrahydroxyisoflavoneChEBI
5,7-dihydroxy-3-(3,4-dihydroxyphenyl)-4-1H-benzopyran-4-oneChemIDplus
isoluteolinChemIDplus
3'-hydroxygenisteinChEBI
norsantalLIPID MAPS
santolChEBI
Manual XrefsDatabases
C10510KEGG COMPOUND
LMPK12050251LIPID MAPS
OrobolWikipedia
HMDB0041658HMDB
C00002554KNApSAcK
Registry NumbersSources
Reaxys:292790Reaxys
CAS:480-23-9KEGG COMPOUND
CAS:480-23-9ChemIDplus
Citations