CHEBI:42017 - 2,4-dinitrophenol

ChEBI IDCHEBI:42017
ChEBI Name2,4-dinitrophenol
Stars
DefinitionA dinitrophenol having the nitro groups at the 2- and 4-positions.
Secondary ChEBI IDsCHEBI:918, CHEBI:42013
Last Modified20 September 2021
DownloadsMolfile
FormulaC6H4N2O5
Net Charge0
Average Mass184.107
Monoisotopic Mass184.01202
SMILESO=[N+]([O-])c1ccc(O)c([N+](=O)[O-])c1
InChIInChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H
InChIKeyUFBJCMHMOXMLKC-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Nocardioides sp. (ncbitaxon:35761) - PubMed (25281383) Strain: JS1661
Roles Classification
Biological Roles:
oxidative phosphorylation inhibitor  Any compound that inhibits oxidative phosphorylation.
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
Applications:
geroprotector  Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
antiseptic drug  A substance used locally on humans and other animals to destroy harmful microorganisms or to inhibit their activity (cf. disinfectants, which destroy microorganisms found on non-living objects, and antibiotics, which can be transported through the lymphatic system to destroy bacteria within the body).
ChEBI Ontology
Outgoing Relation(s)
2,4-dinitrophenol (CHEBI:42017) has role allergen (CHEBI:50904)
2,4-dinitrophenol (CHEBI:42017) has role antiseptic drug (CHEBI:48218)
2,4-dinitrophenol (CHEBI:42017) has role bacterial xenobiotic metabolite (CHEBI:76976)
2,4-dinitrophenol (CHEBI:42017) has role geroprotector (CHEBI:176497)
2,4-dinitrophenol (CHEBI:42017) has role oxidative phosphorylation inhibitor (CHEBI:73267)
2,4-dinitrophenol (CHEBI:42017) is a dinitrophenol (CHEBI:39352)
2,4-dinitrophenol (CHEBI:42017) is conjugate acid of 2,4-dinitrophenol(1−) (CHEBI:84561)
Incoming Relation(s)
4,6-dinitro-o-cresol (CHEBI:39349) has functional parent 2,4-dinitrophenol (CHEBI:42017)
2,4-dinitrophenol(1−) (CHEBI:84561) is conjugate base of 2,4-dinitrophenol (CHEBI:42017)
IUPAC Name 
2,4-dinitrophenol
Synonyms  Source
1-hydroxy-2,4-dinitrobenzeneChemIDplus
2,4-DinitrophenolKEGG COMPOUND
2,4-DINITROPHENOLPDBeChem
2,4-DNPNIST Chemistry WebBook
α-dinitrophenolNIST Chemistry WebBook
Manual XrefsDatabases
2,4-DinitrophenolWikipedia
C02496KEGG COMPOUND
CPD-8179MetaCyc
DB04528DrugBank
DNFPDBeChem
LSM-20951LINCS
Registry NumbersSources
Gmelin:103005Gmelin
Reaxys:1246142Reaxys
Beilstein:1246142Beilstein
CAS:51-28-5ChemIDplus
CAS:51-28-5KEGG COMPOUND
CAS:51-28-5NIST Chemistry WebBook
Citations