EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:190120 - Herbacetin 4'-methyl ether

ChEBI IDCHEBI:190120
ChEBI NameHerbacetin 4'-methyl ether
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H12O7
Net Charge0
Average Mass316.265
Monoisotopic Mass316.05830
SMILESCOc1ccc(-c2oc3c(O)c(O)cc(O)c3c(=O)c2O)cc1
InChIInChI=1S/C16H12O7/c1-22-8-4-2-7(3-5-8)15-14(21)13(20)11-9(17)6-10(18)12(19)16(11)23-15/h2-6,17-19,21H,1H3
InChIKeyJENUDBBUZMVAMW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Brassica napus (ncbitaxon:3708) flower (BTO:0000469) MetaboLights (MTBLS3950)
ChEBI Ontology
Outgoing Relation(s)
Herbacetin 4'-methyl ether (CHEBI:190120) is a hydroxyflavan (CHEBI:72010)
IUPAC Name 
3,5,7,8-tetrahydroxy-2-(4-methoxyphenyl)chromen-4-one
Manual XrefsDatabases
HMDB0132127HMDB
LMPK12113154LIPID MAPS
24845694ChemSpider