CHEBI:86579 - 4-acetoxy-3-methoxy-trans-cinnamaldehyde

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ChEBI Name 4-acetoxy-3-methoxy-trans-cinnamaldehyde ChEBI ID CHEBI:86579 ChEBI ASCII Name 4-acetoxy-3-methoxy-trans-cinnamaldehyde Definition A member of the class of cinnamaldehydes that is cinnamaldehyde substituted by an acetoxy group at position 4 and a methoxy group at position 3 respectively. 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 C12H12O4 Net Charge 0 Average Mass 220.22130 Monoisotopic Mass 220.07356 InChI InChI=1S/C12H12O4/c1-9(14)16-11-6-5-10(4-3-7-13)8-12(11)15-2/h3-8H,1-2H3/b4-3+ InChIKey VEKAJHBFBMWJKI-ONEGZZNKSA-N SMILES COc1cc(\C=C\C=O)ccc1OC(C)=O ChEBI Ontology Outgoing 4-acetoxy-3-methoxy-trans-cinnamaldehyde (CHEBI:86579) has functional parent (E)-cinnamaldehyde (CHEBI:16731) 4-acetoxy-3-methoxy-trans-cinnamaldehyde (CHEBI:86579) is a cinnamaldehydes (CHEBI:23245) 4-acetoxy-3-methoxy-trans-cinnamaldehyde (CHEBI:86579) is a monomethoxybenzene (CHEBI:25235) 4-acetoxy-3-methoxy-trans-cinnamaldehyde (CHEBI:86579) is a phenyl acetates (CHEBI:140310) IUPAC Name 2-methoxy-4-[(1E)-3-oxoprop-1-en-1-yl]phenyl acetate Synonyms Sources 4-(2-Formylvinyl)-2-methoxyphenyl acetate ChemIDplus acetylated coniferylaldehyde ChEBI Registry Numbers Types Sources 3136435 Reaxys Registry Number Reaxys 65401-83-4 CAS Registry Number ChemIDplus Last Modified 03 April 2018