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CHEBI:67421 - 9-O-angeloyl-8,10-dehydrothymol
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ChEBI Ontology
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ChEBI Name
9-O-angeloyl-8,10-dehydrothymol
ChEBI ID
CHEBI:67421
Definition
A natural product found in
Eupatorium cannabinum
subspecies
asiaticum
.
Stars
This entity has been manually annotated by a third party.
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Formula
C15H18O3
Net Charge
0
Average Mass
246.30160
Monoisotopic Mass
246.12559
InChI
InChI=1S/C15H18O3/c1-5-11(3)15(17)18-9-12(4)13-7-6-10(2)8-14(13)16/h5-8,16H,4,9H2,1-3H3/b11-5-
InChIKey
AZIQOUDJDHKSLD-WZUFQYTHSA-N
SMILES
C\C=C(\C)C(=O)OCC(=C)c1ccc(C)cc1O
Metabolite of Species
Details
Eupatorium cannabinum
subsp.
asiaticum
(NCBI:txid102770)
Found in aerial part
(BTO:0001658)
. MeOH extract of shade-dried, pulverized aerial parts See:
PubMed
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
9-O-angeloyl-8,10-dehydrothymol (
CHEBI:67421
)
has role
metabolite (
CHEBI:25212
)
9-O-angeloyl-8,10-dehydrothymol (
CHEBI:67421
)
is a
olefinic compound (
CHEBI:78840
)
Synonym
Source
(Z)-2-(2-hydroxy-4-methylphenyl)allyl 2-methylbut-2-enoate
ChEBI
Citation
Type
Source
21391659
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:styrenes(CHEBI:26799); ISA:hydroxytoluene(CHEBI:24751); ISA:fatty acid ester(CHEBI:35748); ISA:toluenes(CHEBI:27024); ISA:enoate ester(CHEBI:51702); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:organic heterocyclic compound(CHEBI:24532); ISA:ether(CHEBI:25698); ISA:monocarboxylic acid(CHEBI:25384); ISA:organonitrogen compound(CHEBI:35352); ISA:carbonyl compound(CHEBI:36586); ISA:aromatic alcohol(CHEBI:33854);