CHEBI:76046 - (+)-(S)-alapyridaine

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ChEBI Name (+)-(S)-alapyridaine ChEBI ID CHEBI:76046 ChEBI ASCII Name (+)-(S)-alapyridaine Definition An iminium betaine that is L-alanine in which the amino group is replaced by a 5-hydroxy-2-(hydroxymethyl)pyridinium-1-yl moiety. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX 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 C9H11NO4 Net Charge 0 Average Mass 197.18790 Monoisotopic Mass 197.06881 InChI InChI=1S/C9H11NO4/c1-6(9(13)14)10-4-8(12)3-2-7(10)5-11/h2-4,6,11H,5H2,1H3,(H-,12,13,14)/t6-/m0/s1 InChIKey IGOUMBTVEMUDSU-LURJTMIESA-N SMILES C[C@@H](C([O-])=O)[n+]1cc(O)ccc1CO Roles Classification Biological Role(s): flavouring agent A food additive that is used to added improve the taste or odour of a food. Application(s): flavouring agent A food additive that is used to added improve the taste or odour of a food. View more via ChEBI Ontology ChEBI Ontology Outgoing (+)-(S)-alapyridaine (CHEBI:76046) has functional parent L-alanine (CHEBI:16977) (+)-(S)-alapyridaine (CHEBI:76046) has role flavouring agent (CHEBI:35617) (+)-(S)-alapyridaine (CHEBI:76046) is a iminium betaine (CHEBI:35285) IUPAC Name (2S)-2-[5-hydroxy-2-(hydroxymethyl)pyridinium-1-yl]propanoate Synonyms Sources (S)-alapyridaine ChEBI N-(1-carboxyethyl)-6-hydroxymethyl-pyridinium-3-ol SUBMITTER Registry Number Type Source 9553168 Reaxys Registry Number Reaxys Citation Type Source 12826533 PubMed citation SUBMITTER Last Modified 21 May 2015