EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:78688 - 2,4-diacetylphloroglucinol

ChEBI IDCHEBI:78688
ChEBI Name2,4-diacetylphloroglucinol
Stars
DefinitionA benzenetriol that is phloroglucinol in which two of the ring hydrogens are replaced by acetyl groups.
Last Modified2 May 2018
SubmitterSteve
DownloadsMolfile
FormulaC10H10O5
Net Charge0
Average Mass210.185
Monoisotopic Mass210.05282
SMILESCC(=O)c1c(O)cc(O)c(C(C)=O)c1O
InChIInChI=1S/C10H10O5/c1-4(11)8-6(13)3-7(14)9(5(2)12)10(8)15/h3,13-15H,1-2H3
InChIKeyPIFFQYJYNWXNGE-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Lysobacter gummosus (ncbitaxon:262324) - PubMed (18058176)
Pseudomonas fluorescens PF5 (ncbitaxon:1218948) - PubMed (15826166)
Pseudomonas protegens PF5 (ncbitaxon:220664) - PubMed (24742073)
Roles Classification
Biological Roles:
antifungal agent  An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
2,4-diacetylphloroglucinol (CHEBI:78688) has functional parent phloroglucinol (CHEBI:16204)
2,4-diacetylphloroglucinol (CHEBI:78688) has role antifungal agent (CHEBI:35718)
2,4-diacetylphloroglucinol (CHEBI:78688) has role bacterial metabolite (CHEBI:76969)
2,4-diacetylphloroglucinol (CHEBI:78688) is a aromatic ketone (CHEBI:76224)
2,4-diacetylphloroglucinol (CHEBI:78688) is a benzenetriol (CHEBI:22707)
2,4-diacetylphloroglucinol (CHEBI:78688) is a diketone (CHEBI:46640)
2,4-diacetylphloroglucinol (CHEBI:78688) is a methyl ketone (CHEBI:51867)
2,4-diacetylphloroglucinol (CHEBI:78688) is conjugate acid of 2,4-diacetylphloroglucinol(1−) (CHEBI:140662)
Incoming Relation(s)
2,4-diacetylphloroglucinol(1−) (CHEBI:140662) is conjugate base of 2,4-diacetylphloroglucinol (CHEBI:78688)
IUPAC Name 
1,1'-(2,4,6-trihydroxy-1,3-phenylene)diethanone
Synonyms  Source
1,1'-(2,4,6-Trihydroxy-1,3-phenylene)bisethanoneChemIDplus
diacetylphloroglucinolChEBI
5-acetyl-2,4,6-trihydroxyacetophenoneChEBI
2,4,6-trihydroxy-1,3-diacetylbenzeneChEBI
1,5-diacetyl-2,4,6-trihydroxybenzeneChEBI
1-(3-acetyl-2,4,6-trihydroxyphenyl)ethanoneChEBI
Manual XrefsDatabases
2,4-DiacetylphloroglucinolWikipedia
Registry NumbersSources
Reaxys:1881572Reaxys
CAS:2161-86-6ChemIDplus
Citations