The Drug Ontology

Last uploaded: March 3, 2024
Preferred Name

dehydroacetic acid

Synonyms

3-acetyl-6-methyl-2H-pyran-2,4(3H)-dione

Biocide 470F

Methylacetopyronone

Definitions

A pyran-2,4-dione substituted at position 3 by an acetyl group and at position 6 by a methyl group. A fungicide and bactericide it is used primarily in processed fruit and vegetables.

ID

http://purl.obolibrary.org/obo/CHEBI_137426

charge

0

database_cross_reference

Patent:AU2004287448

PMID:6885696

Wikipedia:Dehydroacetic_acid

PMID:23790920

Patent:US3849579

PMID:18960990

PMID:28166217

CAS:520-45-6

AGR:IND87014549

PMID:25813167

PMID:4030634

definition

A pyran-2,4-dione substituted at position 3 by an acetyl group and at position 6 by a methyl group. A fungicide and bactericide it is used primarily in processed fruit and vegetables.

formula

C8H8O4

has role

http://purl.obolibrary.org/obo/CHEBI_24127

http://purl.obolibrary.org/obo/CHEBI_79056

http://purl.obolibrary.org/obo/CHEBI_33282

has_exact_synonym

3-acetyl-6-methyl-2H-pyran-2,4(3H)-dione

has_obo_namespace

chebi_ontology

has_related_synonym

Biocide 470F

Methylacetopyronone

has_RxCUI

1312367

id

CHEBI:137426

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C8H8O4/c1-4-3-6(10)7(5(2)9)8(11)12-4/h3,7H,1-2H3

inchikey

PGRHXDWITVMQBC-UHFFFAOYSA-N

label

dehydroacetic acid

mass

168.147

monoisotopicmass

168.04226

notation

CHEBI:137426

prefLabel

dehydroacetic acid

smiles

C1(C(C(C=C(O1)C)=O)C(=O)C)=O

subClassOf

http://purl.obolibrary.org/obo/CHEBI_137428

http://purl.obolibrary.org/obo/CHEBI_17087

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