CHEBI:78412 - cis-anethole

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ChEBI Name cis-anethole
ChEBI ID CHEBI:78412
ChEBI ASCII Name cis-anethole
Definition The cis-stereoisomer of anethole.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
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/b4-3-
InChIKey RUVINXPYWBROJD-ARJAWSKDSA-N
SMILES COc1ccc(\C=C/C)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.
(via anethole )
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ChEBI Ontology
Outgoing cis-anethole (CHEBI:78412) is a anethole (CHEBI:2716)
IUPAC Name
methyl 4-[(1Z)-prop-1-en-1-yl]phenyl ether
Synonym Source
1-methoxy-4-[(1Z)-prop-1-en-1-yl]benzene IUPAC
Registry Numbers Types Sources
1209632 Reaxys Registry Number Reaxys
25679-28-1 CAS Registry Number ChemIDplus
Last Modified
01 May 2014