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CHEBI:67431 - 8-methoxy-9-O-isobutyrylthymol

ChEBI IDCHEBI:67431
ChEBI Name8-methoxy-9-O-isobutyrylthymol
Stars
DefinitionA natural product found in Eupatorium cannabinum subspecies asiaticum.
Last Modified22 September 2014
DownloadsMolfile
FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESCOC(C)(COC(=O)C(C)C)c1ccc(C)cc1O
InChIInChI=1S/C15H22O4/c1-10(2)14(17)19-9-15(4,18-5)12-7-6-11(3)8-13(12)16/h6-8,10,16H,9H2,1-5H3
InChIKeyJUQOFHFHZAKXEM-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)
8-methoxy-9-O-isobutyrylthymol (CHEBI:67431) has role metabolite (CHEBI:25212)
8-methoxy-9-O-isobutyrylthymol (CHEBI:67431) is a benzyl ether (CHEBI:59859)
Synonym  Source
2-(2-Hydroxy-4-methylphenyl)-2-methoxypropyl 2-methylpropanoateChEBI
Citations