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CHEBI:187266 - Flaccidine

ChEBI IDCHEBI:187266
ChEBI NameFlaccidine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H22O9
Net Charge0
Average Mass442.420
Monoisotopic Mass442.12638
SMILESC/C=C(/C)C(=O)Oc1c(-c2ccc(OC)c(OC)c2)oc2c(OC)c(O)cc(O)c2c1=O
InChIInChI=1S/C23H22O9/c1-6-11(2)23(27)32-22-18(26)17-13(24)10-14(25)20(30-5)21(17)31-19(22)12-7-8-15(28-3)16(9-12)29-4/h6-10,24-25H,1-5H3/b11-6-
InChIKeyNSTVGBOIHUUJLX-WDZFZDKYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Flaccidine (CHEBI:187266) is a ether (CHEBI:25698)
Flaccidine (CHEBI:187266) is a flavonoids (CHEBI:72544)
IUPAC Name 
[2-(3,4-dimethoxyphenyl)-5,7-dihydroxy-8-methoxy-4-oxochromen-3-yl] (Z)-2-methylbut-2-enoate
Manual XrefsDatabases
LMPK12113222LIPID MAPS
24845752ChemSpider