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CHEBI:184499 - Carajuron

ChEBI IDCHEBI:184499
ChEBI NameCarajuron
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H15O5
Net Charge+1
Average Mass287.291
Monoisotopic Mass287.09140
SMILESCOC1=C(O)C(O)C=C2[O+]=C(c3ccc(O)cc3)C=CC21
InChIInChI=1S/C16H14O5/c1-20-16-11-6-7-13(9-2-4-10(17)5-3-9)21-14(11)8-12(18)15(16)19/h2-8,11-12,18H,1H3,(H-,17,19)/p+1
InChIKeyZQBQYJKZPOPIES-UHFFFAOYSA-O
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Carajuron (CHEBI:184499) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
2-(4-hydroxyphenyl)-5-methoxy-4a,7-dihydrochromen-1-ium-6,7-diol
Manual XrefsDatabases
24842484ChemSpider
LMPK12010442LIPID MAPS