EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:199045 - Chlorflavonin A

ChEBI IDCHEBI:199045
ChEBI NameChlorflavonin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H15ClO8
Net Charge0
Average Mass394.763
Monoisotopic Mass394.04555
SMILESCOc1cc(O)c2c(=O)c(OC)c(-c3cc(O)cc(Cl)c3O)oc2c1OC
InChIInChI=1S/C18H15ClO8/c1-24-11-6-10(21)12-14(23)18(26-3)15(27-17(12)16(11)25-2)8-4-7(20)5-9(19)13(8)22/h4-6,20-22H,1-3H3
InChIKeyJEVQBRQMUAVESR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies (ncbitaxon:5065) - PubMed (23457022)
ChEBI Ontology
Outgoing Relation(s)
Chlorflavonin A (CHEBI:199045) is a ether (CHEBI:25698)
Chlorflavonin A (CHEBI:199045) is a flavonoids (CHEBI:72544)
IUPAC Name 
2-(3-chloro-2,5-dihydroxyphenyl)-5-hydroxy-3,7,8-trimethoxychromen-4-one
Manual XrefsDatabases
29214973ChemSpider