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CHEBI:191792 - Methyl cis-p-coumarate 3-(3,7-dimethyl-2,6-octadienyl)

ChEBI IDCHEBI:191792
ChEBI NameMethyl cis-p-coumarate 3-(3,7-dimethyl-2,6-octadienyl)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O3
Net Charge0
Average Mass314.425
Monoisotopic Mass314.18819
SMILESCOC(=O)/C=C/c1ccc(OC/C=C(\C)CCC=C(C)C)cc1
InChIInChI=1S/C20H26O3/c1-16(2)6-5-7-17(3)14-15-23-19-11-8-18(9-12-19)10-13-20(21)22-4/h6,8-14H,5,7,15H2,1-4H3/b13-10+,17-14+
InChIKeyKSSYIBXTLHIBBX-OZZAOFPBSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
bark (BTO:0001301) MetaboLights (MTBLS4572)
seed (BTO:0001226) MetaboLights (MTBLS4572)
ChEBI Ontology
Outgoing Relation(s)
Methyl cis-p-coumarate 3-(3,7-dimethyl-2,6-octadienyl) (CHEBI:191792) is a cinnamate ester (CHEBI:36087)
IUPAC Name 
methyl (E)-3-[4-[(2E)-3,7-dimethylocta-2,6-dienoxy]phenyl]prop-2-enoate
Manual XrefsDatabases
HMDB0041152HMDB
29416077ChemSpider