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> Main
CHEBI:3680 - chrysanthemic acid
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ChEBI Name
chrysanthemic acid
ChEBI ID
CHEBI:3680
Definition
A 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.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C10H16O2
Net Charge
0
Average Mass
168.23284
Monoisotopic Mass
168.11503
InChI
InChI=1S/C10H16O2/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3,(H,11,12)
InChIKey
XLOPRKKSAJMMEW-UHFFFAOYSA-N
SMILES
CC(C)=CC1C(C(O)=O)C1(C)C
Metabolite of Species
Details
Tanacetum cinerariifolium
(NCBI:txid118510)
Isolated by extraction from callus cultures. See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
chrysanthemic acid (
CHEBI:3680
)
has functional parent
cyclopropanecarboxylic acid (
CHEBI:23500
)
chrysanthemic acid (
CHEBI:3680
)
has role
plant metabolite (
CHEBI:76924
)
chrysanthemic acid (
CHEBI:3680
)
is a
cyclopropanes (
CHEBI:51454
)
chrysanthemic acid (
CHEBI:3680
)
is a
monocarboxylic acid (
CHEBI:25384
)
Incoming
ε-momfluorothrin (
CHEBI:87566
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
(
E
Z
)-(1
R
)-empenthrin (
CHEBI:39404
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
allethrin (
CHEBI:34572
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
cyphenothrin (
CHEBI:31450
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
imiprothrin (
CHEBI:39389
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
phenothrin (
CHEBI:34916
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
prallethrin (
CHEBI:39391
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
resmethrin (
CHEBI:8811
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
tetramethrin (
CHEBI:39397
)
has functional parent
chrysanthemic acid (
CHEBI:3680
)
cis
-chrysanthemic acid (
CHEBI:39103
)
is a
chrysanthemic acid (
CHEBI:3680
)
trans
-chrysanthemic acid (
CHEBI:39101
)
is a
chrysanthemic acid (
CHEBI:3680
)
IUPAC Name
2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylic acid
Synonyms
Sources
Chrysanthemic acid
KEGG COMPOUND
chrysanthemummonocarboxylic acid
ChemIDplus
Chrysanthemumsäure
ChEBI
Manual Xrefs
Databases
C09842
KEGG COMPOUND
CN101830795
Patent
LSM-21601
LINCS
US2010210721
Patent
View more database links
Registry Numbers
Types
Sources
10453-89-1
CAS Registry Number
KEGG COMPOUND
10453-89-1
CAS Registry Number
ChemIDplus
2043418
Beilstein Registry Number
ChemIDplus
Citations
Types
Sources
13083
PubMed citation
Europe PMC
16328989
PubMed citation
Europe PMC
17226179
PubMed citation
Europe PMC
24253739
PubMed citation
Europe PMC
Last Modified
25 February 2016