EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:233062 - nepetalactone

ChEBI IDCHEBI:233062
ChEBI Namenepetalactone
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC10H14O2
Net Charge0
Average Mass166.220
Monoisotopic Mass166.09938
SMILESCC1=COC(=O)C2C(C)CCC12
InChIInChI=1S/C10H14O2/c1-6-3-4-8-7(2)5-12-10(11)9(6)8/h5-6,8-9H,3-4H2,1-2H3
InChIKeyZDKZHVNKFOXMND-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Nepeta cataria (ncbitaxon:39347) - PubMed (33667373)
Roles Classification
Application:
insect repellent  An insecticide that acts as a repellent to insects.
ChEBI Ontology
Outgoing Relation(s)
nepetalactone (CHEBI:233062) has role insect repellent (CHEBI:71692)
nepetalactone (CHEBI:233062) is a iridoid monoterpenoid (CHEBI:50563)
IUPAC Name 
4,7-dimethyl-5,6,7,7a-tetrahydro-4aH-cyclopenta[c]pyran-1-one
Synonym  Source
epinepetalactoneSUBMITTER
Manual XrefsDatabases
HMDB0035063HMDB
https://en.wikipedia.org/wiki/NepetalactoneWikipedia
Registry NumbersSources
CAS:490-10-8SUBMITTER
Citations