CHEBI:47905 - coniferyl acetate

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ChEBI Name coniferyl acetate ChEBI ID CHEBI:47905 Definition An acetate ester obtained via formal condensation of the allylic hydroxy function of coniferol with acetic acid. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H14O4 Net Charge 0 Average Mass 222.23716 Monoisotopic Mass 222.08921 InChI InChI=1S/C12H14O4/c1-9(13)16-7-3-4-10-5-6-11(14)12(8-10)15-2/h3-6,8,14H,7H2,1-2H3/b4-3+ InChIKey XLZFUNZRKIQHOL-ONEGZZNKSA-N SMILES COc1cc(\C=C\COC(C)=O)ccc1O ChEBI Ontology Outgoing coniferyl acetate (CHEBI:47905) has functional parent coniferol (CHEBI:17745) coniferyl acetate (CHEBI:47905) is a acetate ester (CHEBI:47622) coniferyl acetate (CHEBI:47905) is a coniferyl ester (CHEBI:64292) coniferyl acetate (CHEBI:47905) is a phenols (CHEBI:33853) IUPAC Name (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl acetate Synonyms Sources (E)-coniferyl acetate UniProt coniferyl-9-O-acetate ChEBI Manual Xrefs Databases CPD-9875 MetaCyc DE3211773 Patent View more database links Registry Numbers Types Sources 5433401 Beilstein Registry Number Beilstein 5433401 Reaxys Registry Number Reaxys Citations Types Sources 16782809 PubMed citation Europe PMC 17241449 PubMed citation Europe PMC 17912370 PubMed citation Europe PMC 18208524 PubMed citation Europe PMC 18987218 PubMed citation Europe PMC 19222805 PubMed citation Europe PMC Last Modified 07 July 2020