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CHEBI:193268 - Annulatin

ChEBI IDCHEBI:193268
ChEBI NameAnnulatin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H12O8
Net Charge0
Average Mass332.264
Monoisotopic Mass332.05322
SMILESCOc1c(-c2cc(O)c(O)c(O)c2)oc2cc(O)cc(O)c2c1=O
InChIInChI=1S/C16H12O8/c1-23-16-14(22)12-8(18)4-7(17)5-11(12)24-15(16)6-2-9(19)13(21)10(20)3-6/h2-5,17-21H,1H3
InChIKeyXWTLYULBWZQAAZ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
Annulatin (CHEBI:193268) is a ether (CHEBI:25698)
Annulatin (CHEBI:193268) is a flavonoids (CHEBI:72544)
IUPAC Name 
5,7-dihydroxy-3-methoxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
Manual XrefsDatabases
24227213ChemSpider
LMPK12112779LIPID MAPS
Registry NumbersSources
CAS:1486-67-5ChemIDplus