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CHEBI:193198 - Alluaudiol

ChEBI IDCHEBI:193198
ChEBI NameAlluaudiol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H14O8
Net Charge0
Average Mass346.291
Monoisotopic Mass346.06887
SMILESCOc1c(-c2cc(O)c(O)c(O)c2)oc2cc(O)c(C)c(O)c2c1=O
InChIInChI=1S/C17H14O8/c1-6-8(18)5-11-12(13(6)21)15(23)17(24-2)16(25-11)7-3-9(19)14(22)10(20)4-7/h3-5,18-22H,1-2H3
InChIKeyNYLZWWYZSQFXJT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
Alluaudiol (CHEBI:193198) is a ether (CHEBI:25698)
Alluaudiol (CHEBI:193198) is a flavonoids (CHEBI:72544)
IUPAC Name 
5,7-dihydroxy-3-methoxy-6-methyl-2-(3,4,5-trihydroxyphenyl)chromen-4-one
Manual XrefsDatabases
LMPK12112777LIPID MAPS
24845408ChemSpider