CHEBI:16016 - dihydroxyacetone

ChEBI IDCHEBI:16016
ChEBI Namedihydroxyacetone
Stars
DefinitionA ketotriose consisting of acetone bearing hydroxy substituents at positions 1 and 3. The simplest member of the class of ketoses and the parent of the class of glycerones.
Secondary ChEBI IDsCHEBI:5453, CHEBI:14340, CHEBI:24354, CHEBI:39809
Last Modified6 February 2018
DownloadsMolfile
FormulaC3H6O3
Net Charge0
Average Mass90.078
Monoisotopic Mass90.03169
SMILESO=C(CO)CO
InChIInChI=1S/C3H6O3/c4-1-3(6)2-5/h4-5H,1-2H2
InChIKeyRXKJFZQQPQGTFL-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
dihydroxyacetone (CHEBI:16016) has role Escherichia coli metabolite (CHEBI:76971)
dihydroxyacetone (CHEBI:16016) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
dihydroxyacetone (CHEBI:16016) has role antifungal agent (CHEBI:35718)
dihydroxyacetone (CHEBI:16016) has role human metabolite (CHEBI:77746)
dihydroxyacetone (CHEBI:16016) has role metabolite (CHEBI:25212)
dihydroxyacetone (CHEBI:16016) has role mouse metabolite (CHEBI:75771)
dihydroxyacetone (CHEBI:16016) is a ketotriose (CHEBI:24982)
dihydroxyacetone (CHEBI:16016) is a primary α-hydroxy ketone (CHEBI:139590)
Incoming Relation(s)
1-hydroxy-3-methoxyacetone (CHEBI:37551) has functional parent dihydroxyacetone (CHEBI:16016)
1-palmitoylglycerone 3-phosphate (CHEBI:17868) has functional parent dihydroxyacetone (CHEBI:16016)
1-stearoylglycerone 3-phosphate (CHEBI:36476) has functional parent dihydroxyacetone (CHEBI:16016)
dihydroxyacetone phosphate (CHEBI:16108) has functional parent dihydroxyacetone (CHEBI:16016)
glycerone derivative (CHEBI:24358) has functional parent dihydroxyacetone (CHEBI:16016)
glycerone phosphate(2−) (CHEBI:57642) has functional parent dihydroxyacetone (CHEBI:16016)
glycerone sulfate (CHEBI:27894) has functional parent dihydroxyacetone (CHEBI:16016)
IUPAC Name 
1,3-dihydroxypropan-2-one
Synonyms  Source
1,3-Dihydroxy-2-propanoneKEGG COMPOUND
1,3-DihydroxyacetoneKEGG COMPOUND
1,3-Dihydroxydimethyl ketoneChemIDplus
1,3-Dihydroxypropan-2-oneKEGG COMPOUND
1,3-DihydroxypropanoneChemIDplus
1,3-propanediol-2-oneChEBI
UniProt Name  Source
dihydroxyacetoneUniProt
Manual XrefsDatabases
2HAPDBeChem
C00184KEGG COMPOUND
D07841KEGG DRUG
DB01775DrugBank
DihydroxyacetoneWikipedia
DIHYDROXYACETONEMetaCyc
HMDB0001882HMDB
Registry NumbersSources
Reaxys:1740268Reaxys
CAS:96-26-4ChemIDplus
CAS:96-26-4KEGG COMPOUND
CAS:96-26-4NIST Chemistry WebBook
Citations