EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:168374 - 2-(2,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4H-chromen-4-one

ChEBI IDCHEBI:168374
ChEBI Name2-(2,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4H-chromen-4-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H10O8
Net Charge0
Average Mass318.237
Monoisotopic Mass318.03757
SMILESO=c1c(O)c(-c2ccc(O)cc2O)oc2cc(O)c(O)c(O)c12
InChIInChI=1S/C15H10O8/c16-5-1-2-6(7(17)3-5)15-14(22)13(21)10-9(23-15)4-8(18)11(19)12(10)20/h1-4,16-20,22H
InChIKeyCUFIKWCCUWCTCX-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
2-(2,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4H-chromen-4-one (CHEBI:168374) is a hydroxyflavan (CHEBI:72010)
IUPAC Name 
2-(2,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxychromen-4-one
Manual XrefsDatabases
HMDB0131755HMDB
74852935ChemSpider