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CHEBI:168044 - Gnaphaliin

ChEBI IDCHEBI:168044
ChEBI NameGnaphaliin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H14O6
Net Charge0
Average Mass314.293
Monoisotopic Mass314.07904
SMILESCOc1c(-c2ccccc2)oc2c(OC)c(O)cc(O)c2c1=O
InChIInChI=1S/C17H14O6/c1-21-15-11(19)8-10(18)12-13(20)17(22-2)14(23-16(12)15)9-6-4-3-5-7-9/h3-8,18-19H,1-2H3
InChIKeyOWQLBLNRUZULFV-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)
Gnaphaliin (CHEBI:168044) is a ether (CHEBI:25698)
Gnaphaliin (CHEBI:168044) is a flavonoids (CHEBI:72544)
IUPAC Name 
5,7-dihydroxy-3,8-dimethoxy-2-phenylchromen-4-one
Manual XrefsDatabases
LMPK12113093LIPID MAPS
HMDB0030544HMDB
8148502ChemSpider