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CHEBI:185494 - 8-Cinnamoyl-3,4-dihydro-5,7-dihydroxy-4-phenylcoumarin

ChEBI IDCHEBI:185494
ChEBI Name8-Cinnamoyl-3,4-dihydro-5,7-dihydroxy-4-phenylcoumarin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H18O5
Net Charge0
Average Mass386.403
Monoisotopic Mass386.11542
SMILESO=C1CC(c2ccccc2)c2c(O)cc(O)c(C(=O)/C=C/c3ccccc3)c2O1
InChIInChI=1S/C24H18O5/c25-18(12-11-15-7-3-1-4-8-15)23-20(27)14-19(26)22-17(13-21(28)29-24(22)23)16-9-5-2-6-10-16/h1-12,14,17,26-27H,13H2/b12-11+
InChIKeyXNMQCWKDPWDEMC-VAWYXSNFSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
8-Cinnamoyl-3,4-dihydro-5,7-dihydroxy-4-phenylcoumarin (CHEBI:185494) is a diarylheptanoid (CHEBI:78802)
IUPAC Name 
5,7-dihydroxy-4-phenyl-8-[(E)-3-phenylprop-2-enoyl]-3,4-dihydrochromen-2-one
Manual XrefsDatabases
LMPK12120227LIPID MAPS
24845964ChemSpider