CHEBI:140662 - 2,4-diacetylphloroglucinol(1−)

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ChEBI Name 2,4-diacetylphloroglucinol(1−)
ChEBI ID CHEBI:140662
ChEBI ASCII Name 2,4-diacetylphloroglucinol(1-)
Definition A phenolate anion that is the conjugate base of 2,4-diacetylphloroglucinol, obtained by deprotonation of one of the two hydroxy groups at position 1 and 5. Major microspecies at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C10H9O5
Net Charge -1
Average Mass 209.178
Monoisotopic Mass 209.04555
InChI InChI=1S/C10H10O5/c1-4(11)8-6(13)3-7(14)9(5(2)12)10(8)15/h3,13-15H,1-2H3/p-1
InChIKey PIFFQYJYNWXNGE-UHFFFAOYSA-M
SMILES C1(=CC([O-])=C(C(=C1C(C)=O)O)C(=O)C)O
Roles Classification
Biological Role(s): antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
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ChEBI Ontology
Outgoing 2,4-diacetylphloroglucinol(1−) (CHEBI:140662) has role antifungal agent (CHEBI:35718)
2,4-diacetylphloroglucinol(1−) (CHEBI:140662) is a phenolate anion (CHEBI:50525)
2,4-diacetylphloroglucinol(1−) (CHEBI:140662) is conjugate base of 2,4-diacetylphloroglucinol (CHEBI:78688)
Incoming 2,4-diacetylphloroglucinol (CHEBI:78688) is conjugate acid of 2,4-diacetylphloroglucinol(1−) (CHEBI:140662)
IUPAC Name
2,4-diacetyl-3,5-dihydroxyphenolate
Synonym Source
2,4-diacetylphloroglucinol UniProt
Last Modified
23 September 2019