CHEBI:138669 - N-methyl-β-alanine

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ChEBI Name N-methyl-β-alanine ChEBI ID CHEBI:138669 ChEBI ASCII Name N-methyl-beta-alanine Definition A β-amino acid that is propionic acid in which one of the hydrogens at position 3 has been replaced by a methylamino group. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C4H9NO2 Net Charge 0 Average Mass 103.120 Monoisotopic Mass 103.06333 InChI InChI=1S/C4H9NO2/c1-5-3-2-4(6)7/h5H,2-3H2,1H3,(H,6,7) InChIKey VDIPNVCWMXZNFY-UHFFFAOYSA-N SMILES C(CCNC)(=O)O Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing N-methyl-β-alanine (CHEBI:138669) has functional parent β-alanine (CHEBI:16958) N-methyl-β-alanine (CHEBI:138669) is a β-amino acid (CHEBI:33706) N-methyl-β-alanine (CHEBI:138669) is a secondary amino compound (CHEBI:50995) Incoming N,N-dimethyl-β-alanine (CHEBI:138668) has functional parent N-methyl-β-alanine (CHEBI:138669) IUPAC Name N-methyl-β-alanine Synonyms Sources 3-(methylamino)propanoic acid IUPAC 3-(methylamino)propionic acid IUPAC 3-methylaminopropanoic acid ChEBI 3-methylaminopropionic acid ChEBI Manual Xref Database CPD-6141 MetaCyc View more database links Registry Numbers Types Sources 2679-14-3 CAS Registry Number ChemIDplus 773862 Reaxys Registry Number Reaxys Citation Type Source 16591973 PubMed citation Europe PMC Last Modified 12 October 2017