CHEBI:86599 - coniferyl p-coumarate

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ChEBI Name coniferyl p-coumarate ChEBI ID CHEBI:86599 ChEBI ASCII Name coniferyl p-coumarate Definition A cinnamate ester obtained by the formal condensation of the hydroxy of coniferol with the carboxy group of trans-4-coumaric 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 C19H18O5 Net Charge 0 Average Mass 326.34320 Monoisotopic Mass 326.11542 InChI InChI=1S/C19H18O5/c1-23-18-13-15(6-10-17(18)21)3-2-12-24-19(22)11-7-14-4-8-16(20)9-5-14/h2-11,13,20-21H,12H2,1H3/b3-2+,11-7+ InChIKey UPNLRNQUIJXYPN-LFWRRJNUSA-N SMILES COc1cc(\C=C\COC(=O)\C=C\c2ccc(O)cc2)ccc1O ChEBI Ontology Outgoing coniferyl p-coumarate (CHEBI:86599) has functional parent trans-4-coumaric acid (CHEBI:32374) coniferyl p-coumarate (CHEBI:86599) has functional parent coniferol (CHEBI:17745) coniferyl p-coumarate (CHEBI:86599) is a cinnamate ester (CHEBI:36087) coniferyl p-coumarate (CHEBI:86599) is a guaiacols (CHEBI:134251) IUPAC Name (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoate Registry Number Type Source 7649308 Reaxys Registry Number Reaxys Last Modified 07 April 2017