CHEBI:192913 - Butyl cinnamate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Butyl cinnamate
ChEBI ID CHEBI:192913
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H16O2
Net Charge 0
Average Mass 204.269
Monoisotopic Mass 204.11503
InChI InChI=1S/C13H16O2/c1-2-3-11-15-13(14)10-9-12-7-5-4-6-8-12/h4-10H,2-3,11H2,1H3/b10-9+
InChIKey OHHIVLJVBNCSHV-MDZDMXLPSA-N
SMILES O(CCCC)C(=O)\C=C\C1=CC=CC=C1
Metabolite of Species Details
Cryptomeria (NCBI:txid3368) Found in needle (BTO:0000917). of strain Cryptomeria fortunei Hooibrenk See: MetaboLights Study
ChEBI Ontology
Outgoing Butyl cinnamate (CHEBI:192913) is a cinnamate ester (CHEBI:36087)
IUPAC Name
butyl (E)-3-phenylprop-2-enoate
Manual Xref Database
4437889 ChemSpider
View more database links
Registry Number Type Source
538-65-8 CAS Registry Number ChemIDplus