CHEBI:31746 - kainic acid

ChEBI IDCHEBI:31746
ChEBI Namekainic acid
Stars
Last Modified22 February 2017
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FormulaC10H15NO4
Net Charge0
Average Mass213.233
Monoisotopic Mass213.10011
SMILESC=C(C)[C@H]1CN[C@H](C(=O)O)[C@H]1CC(=O)O
InChIInChI=1S/C10H15NO4/c1-5(2)7-4-11-9(10(14)15)6(7)3-8(12)13/h6-7,9,11H,1,3-4H2,2H3,(H,12,13)(H,14,15)/t6-,7+,9-/m0/s1
InChIKeyVLSMHEGGTFMBBZ-OOZYFLPDSA-N
Roles Classification
Chemical Roles:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
excitatory amino acid agonist  An agent that binds to and activates excitatory amino acid receptors.
Applications:
antinematodal drug  A substance used in the treatment or control of nematode infestations.
excitatory amino acid agonist  An agent that binds to and activates excitatory amino acid receptors.
ChEBI Ontology
Outgoing Relation(s)
kainic acid (CHEBI:31746) has role antinematodal drug (CHEBI:35444)
kainic acid (CHEBI:31746) has role excitatory amino acid agonist (CHEBI:50103)
kainic acid (CHEBI:31746) is a L-proline derivative (CHEBI:84186)
kainic acid (CHEBI:31746) is a dicarboxylic acid (CHEBI:35692)
kainic acid (CHEBI:31746) is a non-proteinogenic L-α-amino acid (CHEBI:83822)
kainic acid (CHEBI:31746) is a pyrrolidinecarboxylic acid (CHEBI:46767)
kainic acid (CHEBI:31746) is conjugate acid of kainate(1−) (CHEBI:156548)
Incoming Relation(s)
dihydrokainic acid (CHEBI:43562) has functional parent kainic acid (CHEBI:31746)
kainate(1−) (CHEBI:156548) is conjugate base of kainic acid (CHEBI:31746)
IUPAC Name 
(3S,4R)-3-(carboxymethyl)-4-(prop-1-en-2-yl)-L-proline
INNs  Source
acide kaïniqueChemIDplus
ácido kaínicoChemIDplus
acidum kainicumChemIDplus
kainic acidChemIDplus
Synonyms  Source
(2S-(2α,3β,4β))-2-carboxy-4-(1-methylethenyl)-3-pyrrolidineacetic acidChemIDplus
alpha- Kainic acidKEGG COMPOUND
alpha-Kainic acidKEGG COMPOUND
digenic acidChemIDplus
DigeninChemIDplus
DigensäureChEBI
Manual XrefsDatabases
3201DrugCentral
C12819KEGG COMPOUND
GB795750Patent
KAIPDBeChem
US2902492Patent
US2954384Patent
Registry NumbersSources
Beilstein:86660Beilstein
CAS:487-79-6ChemIDplus
CAS:487-79-6KEGG COMPOUND