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> Main
CHEBI:2716 - anethole
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ChEBI Name
anethole
ChEBI ID
CHEBI:2716
Definition
A monomethoxybenzene that is methoxybenzene substituted by a prop-1-en-1-yl group at position 4.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C10H12O
Net Charge
0
Average Mass
148.20170
Monoisotopic Mass
148.08882
InChI
InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3
InChIKey
RUVINXPYWBROJD-UHFFFAOYSA-N
SMILES
COc1ccc(C=CC)cc1
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
anethole (
CHEBI:2716
)
has role
plant metabolite (
CHEBI:76924
)
anethole (
CHEBI:2716
)
is a
monomethoxybenzene (
CHEBI:25235
)
Incoming
cis
-anethole (
CHEBI:78412
)
is a
anethole (
CHEBI:2716
)
trans
-anethole (
CHEBI:35616
)
is a
anethole (
CHEBI:2716
)
IUPAC Name
1-methoxy-4-(prop-1-en-1-yl)benzene
Synonyms
Sources
methyl 4-(prop-1-en-1-yl)phenyl ether
IUPAC
p-propenylanisole
ChEBI
Manual Xref
Database
LSM-37103
LINCS
View more database links
Registry Numbers
Types
Sources
104-46-1
CAS Registry Number
ChemIDplus
774229
Reaxys Registry Number
Reaxys
Citation
Type
Source
24689303
PubMed citation
Europe PMC
Last Modified
26 February 2016