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CHEBI:67430 - 9-isobutyryloxy-8,10-dehydrothymol

ChEBI IDCHEBI:67430
ChEBI Name9-isobutyryloxy-8,10-dehydrothymol
Stars
DefinitionA natural product found in Eupatorium cannabinum subspecies asiaticum.
Last Modified22 September 2014
DownloadsMolfile
FormulaC14H18O3
Net Charge0
Average Mass234.295
Monoisotopic Mass234.12559
SMILESC=C(COC(=O)C(C)C)c1ccc(C)cc1O
InChIInChI=1S/C14H18O3/c1-9(2)14(16)17-8-11(4)12-6-5-10(3)7-13(12)15/h5-7,9,15H,4,8H2,1-3H3
InChIKeyOJQZUKANZQGITH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Eupatorium cannabinum subsp. asiaticum (ncbitaxon:102770) aerial part (BTO:0001658) PubMed (21391659) MeOH extract of shade-dried, pulverized aerial parts
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
9-isobutyryloxy-8,10-dehydrothymol (CHEBI:67430) has role metabolite (CHEBI:25212)
9-isobutyryloxy-8,10-dehydrothymol (CHEBI:67430) is a olefinic compound (CHEBI:78840)
Synonym  Source
2-(2-Hydroxy-4-methylphenyl)-2-propen-1-yl 2-methylpropanoateChEBI
Citations