CHEBI:182782 - 1-(3,4-dimethoxyphenyl)propyl (Z)-2-[[(E)-2-methylbut-2-enoyl]oxymethyl]but-2-enoate

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ChEBI Name 1-(3,4-dimethoxyphenyl)propyl (Z)-2-[[(E)-2-methylbut-2-enoyl]oxymethyl]but-2-enoate
ChEBI ID CHEBI:182782
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H28O6
Net Charge 0
Average Mass 376.449
Monoisotopic Mass 376.18859
InChI InChI=1S/C21H28O6/c1-7-14(4)20(22)26-13-15(8-2)21(23)27-17(9-3)16-10-11-18(24-5)19(12-16)25-6/h7-8,10-12,17H,9,13H2,1-6H3/b14-7+,15-8-
InChIKey LKOARHYUMOKAPJ-GOBHWCIESA-N
SMILES O(C(CC)C1=CC(OC)=C(OC)C=C1)C(=O)/C(/COC(=O)/C(/C)=C/C)=C\C
ChEBI Ontology
Outgoing 1-(3,4-dimethoxyphenyl)propyl (Z)-2-[[(E)-2-methylbut-2-enoyl]oxymethyl]but-2-enoate (CHEBI:182782) has functional parent benzyl alcohol (CHEBI:17987)
1-(3,4-dimethoxyphenyl)propyl (Z)-2-[[(E)-2-methylbut-2-enoyl]oxymethyl]but-2-enoate (CHEBI:182782) is a carboxylic ester (CHEBI:33308)
IUPAC Name
1-(3,4-dimethoxyphenyl)propyl (Z)-2-[[(E)-2-methylbut-2-enoyl]oxymethyl]but-2-enoate
Manual Xref Database
22913459 ChemSpider
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