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CHEBI:3680 - chrysanthemic acid

ChEBI IDCHEBI:3680
ChEBI Namechrysanthemic acid
Stars
DefinitionA monocarboxylic acid that is cyclopropanecarboxylic acid substituted by two methyl groups at position 2 and a 2-methylprop-1-en-1-yl group at position 3.
Last Modified25 February 2016
DownloadsMolfile

FormulaC10H16O2
Net Charge0
Average Mass168.236
Monoisotopic Mass168.11503
SMILESCC(C)=CC1C(C(=O)O)C1(C)C
InChIInChI=1S/C10H16O2/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3,(H,11,12)
InChIKeyXLOPRKKSAJMMEW-UHFFFAOYSA-N

Species of MetaboliteComponentSourceComments
Tanacetum cinerariifolium (ncbitaxon:118510) - PubMed (24253739) Isolated by extraction from callus cultures.
Roles Classification

ChEBI Ontology
IUPAC Name 
2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylic acid
Synonyms  Source
Chrysanthemic acidKEGG COMPOUND
chrysanthemummonocarboxylic acidChemIDplus
Chrysanthemumsäure  deChEBI
Manual XrefsDatabases
C09842KEGG COMPOUND
CN101830795Patent
US2010210721Patent
LSM-21601LINCS
Registry NumbersSources
Beilstein:2043418Beilstein
CAS:10453-89-1KEGG COMPOUND
CAS:10453-89-1ChemIDplus
Citations