CHEBI:89729 - (Z)-3-phenyl-2-propenal

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (Z)-3-phenyl-2-propenal
ChEBI ID CHEBI:89729
ChEBI ASCII Name (Z)-3-phenyl-2-propenal
Definition A 3-phenylprop-2-enal that has Z configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C9H8O
Net Charge 0
Average Mass 132.160
Monoisotopic Mass 132.05751
InChI InChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4-
InChIKey KJPRLNWUNMBNBZ-DAXSKMNVSA-N
SMILES C1=CC=C(C=C1)/C=C\C=O
Metabolite of Species Details
Cinnamomum aromaticum (NCBI:txid119260) Found in bark (BTO:0001301). From hydrodistilled bark essential oil See: J. Sci. Food Agric., 2009, 89, 1241-1246
Buddleja davidii (NCBI:txid28540) Found in volatile compounds collected from air over clusters of butterfly bush flowers See: The Florida Entomologist 2008, 91, 576-582
Cinnamomum tamala (NCBI:txid397098) Found in leaf (BTO:0000713). See: PubMed
Homo sapiens (NCBI:txid9606) Found in faeces (UBERON:0001988). See: PubMed
Homo sapiens (NCBI:txid9606) Found in saliva (UBERON:0001836). See: PubMed
Roles Classification
Biological Role(s): volatile oil component
Any plant metabolite that is found naturally as a component of a volatile oil.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (Z)-3-phenyl-2-propenal (CHEBI:89729) has role volatile oil component (CHEBI:27311)
(Z)-3-phenyl-2-propenal (CHEBI:89729) is a 3-phenylprop-2-enal (CHEBI:142921)
(Z)-3-phenyl-2-propenal (CHEBI:89729) is a cinnamaldehydes (CHEBI:23245)
IUPAC Names
(2Z)-3-phenylacrylaldehyde
(2Z)-3-phenylprop-2-enal
Synonyms Sources
(Z)-3-phenyl-2-propenal ChemIDplus
(Z)-cinnamaldehyde ChemIDplus
cis-cinnamaldehyde ChemIDplus
cis-cinnamic aldehyde HMDB
Manual Xrefs Databases
GB2045049 Patent
HMDB0032072 HMDB
View more database links
Registry Numbers Types Sources
57194-69-1 CAS Registry Number KEGG COMPOUND
57194-69-1 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
19167006 PubMed citation Europe PMC
21707253 PubMed citation Europe PMC
24421258 PubMed citation Europe PMC
IND44147048 Agricola citation Europe PMC
IND44193322 Agricola citation Europe PMC
Last Modified
16 January 2019