CHEBI:15870 - betaine aldehyde hydrate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name betaine aldehyde hydrate
ChEBI ID CHEBI:15870
Definition A quaternary ammonium ion that is the hydrate of betaine aldehyde.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:13897, CHEBI:3075
Supplier Information
Download Molfile XML SDF
Formula C5H14NO2
Net Charge +1
Average Mass 120.17020
Monoisotopic Mass 120.10191
InChI InChI=1S/C5H14NO2/c1-6(2,3)4-5(7)8/h5,7-8H,4H2,1-3H3/q+1
InChIKey HEHORKLRCFPRON-UHFFFAOYSA-N
SMILES C[N+](C)(C)CC(O)O
ChEBI Ontology
Outgoing betaine aldehyde hydrate (CHEBI:15870) is a aldehyde hydrate (CHEBI:63733)
betaine aldehyde hydrate (CHEBI:15870) is a quaternary ammonium ion (CHEBI:35267)
IUPAC Name
2,2-dihydroxy-N,N,N-trimethylethanaminium
Synonyms Sources
betaine aldehyde hydrate UniProt
glycine betaine aldehyde hydrate ChEBI
Manual Xrefs Databases
BETAINE-ALDEHYDE-HYDRATE MetaCyc
C07345 KEGG COMPOUND
View more database links
Registry Number Type Source
1741515 Reaxys Registry Number Reaxys
Last Modified
20 June 2014