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CHEBI:69061 - Betaine homarine

ChEBI IDCHEBI:69061
ChEBI NameBetaine homarine
Stars
DefinitionA natural product found in Paramuricea clavata.
Last Modified18 April 2024
DownloadsMolfile
FormulaC7H7NO2
Net Charge0
Average Mass137.138
Monoisotopic Mass137.04768
SMILESC[n+]1ccccc1C(=O)[O-]
InChIInChI=1S/C7H7NO2/c1-8-5-3-2-4-6(8)7(9)10/h2-5H,1H3
InChIKeyBRTLKRNVNFIOPJ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Paramuricea clavata (ncbitaxon:317549) - PubMed (21939218) CH2Cl2:MeOH(1:1) extract of lyophilized material
Cucumaria georgiana (ncbitaxon:864626) - MetaboLights (MTBLS336)
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).
ChEBI Ontology
Outgoing Relation(s)
Betaine homarine (CHEBI:69061) is a non-proteinogenic α-amino acid (CHEBI:83925)
Synonyms  Source
n-methylpicolinic acidChEBI
HomarineChEBI
1-methylpyridinium-2-carboxylateChEBI
Citations