CHEBI:5854 - Ibotenic acid

ChEBI IDCHEBI:5854
ChEBI NameIbotenic acid
Stars
Last Modified26 March 2015
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FormulaC5H6N2O4
Net Charge0
Average Mass158.113
Monoisotopic Mass158.03276
SMILESNC(C(=O)O)c1cc(O)no1
InChIInChI=1S/C5H6N2O4/c6-4(5(9)10)2-1-3(8)7-11-2/h1,4H,6H2,(H,7,8)(H,9,10)
InChIKeyIRJCBFDCFXCWGO-UHFFFAOYSA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
neurotoxin  A poison that interferes with the functions of the nervous system.
ChEBI Ontology
Outgoing Relation(s)
Ibotenic acid (CHEBI:5854) has role neurotoxin (CHEBI:50910)
Ibotenic acid (CHEBI:5854) is a non-proteinogenic α-amino acid (CHEBI:83925)
Synonym  Source
Ibotenic acidKEGG COMPOUND
Manual XrefsDatabases
C10600KEGG COMPOUND
C00002345KNApSAcK
Registry NumbersSources
CAS:2552-55-8KEGG COMPOUND