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
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Biological Roles:
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 ).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
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
GlyceroneKEGG COMPOUND
DihydroxyacetoneKEGG COMPOUND
1,3-DihydroxyacetoneKEGG COMPOUND
1,3-Dihydroxy-2-propanoneKEGG COMPOUND
1,3-Dihydroxypropan-2-oneKEGG COMPOUND
1,3-Dihydroxydimethyl ketoneChemIDplus
UniProt Name  Source
dihydroxyacetoneUniProt
Manual XrefsDatabases
C00184KEGG COMPOUND
2HAPDBeChem
HMDB0001882HMDB
DIHYDROXYACETONEMetaCyc
DihydroxyacetoneWikipedia
DB01775DrugBank
D07841KEGG DRUG
Registry NumbersSources
Reaxys:1740268Reaxys
CAS:96-26-4KEGG COMPOUND
CAS:96-26-4ChemIDplus
CAS:96-26-4NIST Chemistry WebBook
Citations