CHEBI:15710 - betaine aldehyde

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ChEBI Name betaine aldehyde
ChEBI ID CHEBI:15710
Definition A quaternary ammonium ion that is nitrogen substituted by three methyl groups and a 2-oxoethyl group. It is an intermediate in the metabolism of amino acids like glycine, serine and threonine.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:3074, CHEBI:41256, CHEBI:22859, CHEBI:13896
Supplier Information ZINC000001532567
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β-Carotene (beta-carotene) is an organic, strongly colored red-orange pigment abundant in fungi, plants, and fruits. It is a member of the carotenes, which are terpenoids (isoprenoids), synthesized biochemically from eight isoprene units and thus having 40 carbons. Dietary β-carotene is a provitamin A compound, converting in the body to retinol (vitamin A). In foods, it has rich content in carrots, pumpkin, spinach, and sweet potato. It is used as a dietary supplement and may be prescribed to treat erythropoietic protoporphyria, an inherited condition of sunlight sensitivity. β-carotene is the most common carotenoid in plants. When used as a food coloring, it has the E number E160a.: 119  The structure was deduced in 1930. Isolation of β-carotene from fruits abundant in carotenoids is commonly done using column chromatography. It is industrially extracted from richer sources such as the algae Dunaliella salina. The separation of β-carotene from the mixture of other carotenoids is based on the polarity of a compound. β-Carotene is a non-polar compound, so it is separated with a non-polar solvent such as hexane. Being highly conjugated, it is deeply colored, and as a hydrocarbon lacking functional groups, it is lipophilic.
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Formula C5H12NO
Net Charge +1
Average Mass 102.15490
Monoisotopic Mass 102.09134
InChI InChI=1S/C5H12NO/c1-6(2,3)4-5-7/h5H,4H2,1-3H3/q+1
InChIKey SXKNCCSPZDCRFD-UHFFFAOYSA-N
SMILES [H]C(=O)C[N+](C)(C)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Escherichia coli (NCBI:txid562) See: PubMed
Escherichia coli (NCBI:txid562) See: PubMed
Aspergillus fumigatus (NCBI:txid746128) See: PubMed
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Aspergillus metabolite
Any fungal metabolite produced during a metabolic reaction in the mould, Aspergillus .
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
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ChEBI Ontology
Outgoing betaine aldehyde (CHEBI:15710) has role Aspergillus metabolite (CHEBI:76956)
betaine aldehyde (CHEBI:15710) has role Escherichia coli metabolite (CHEBI:76971)
betaine aldehyde (CHEBI:15710) has role human metabolite (CHEBI:77746)
betaine aldehyde (CHEBI:15710) has role mouse metabolite (CHEBI:75771)
betaine aldehyde (CHEBI:15710) has role plant metabolite (CHEBI:76924)
betaine aldehyde (CHEBI:15710) is a quaternary ammonium ion (CHEBI:35267)
IUPAC Name
N,N,N-trimethyl-2-oxoethanaminium
Synonyms Sources
BETAINE ALDEHYDE PDBeChem
Betaine aldehyde KEGG COMPOUND
betaine aldehyde UniProt
glycine betaine aldehyde ChEBI
Manual Xrefs Databases
Betaine_aldehyde Wikipedia
BTL PDBeChem
C00576 KEGG COMPOUND
DB04401 DrugBank
HMDB0001252 HMDB
View more database links
Registry Numbers Types Sources
1748566 Reaxys Registry Number Reaxys
7418-61-3 CAS Registry Number KEGG COMPOUND
7418-61-3 CAS Registry Number ChemIDplus
Citations Types Sources
22569963 PubMed citation Europe PMC
23563483 PubMed citation Europe PMC
23823928 PubMed citation Europe PMC
24747910 PubMed citation Europe PMC
Last Modified
27 January 2016