CHEBI:42017 - 2,4-dinitrophenol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2,4-dinitrophenol
ChEBI ID CHEBI:42017
Definition A dinitrophenol having the nitro groups at the 2- and 4-positions.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:42013, CHEBI:918
Supplier Information
Download Molfile XML SDF
more structures >>
Wikipedia License
Waiting for wikipedia content
Read full article at Wikipedia
Formula C6H4N2O5
Net Charge 0
Average Mass 184.10640
Monoisotopic Mass 184.012
InChI InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H
InChIKey UFBJCMHMOXMLKC-UHFFFAOYSA-N
SMILES Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
Metabolite of Species Details
Nocardioides sp. (NCBI:35761) of strain JS1661 See: PubMed
Roles Classification
Biological Role(s): oxidative phosphorylation inhibitor
Any compound that inhibits oxidative phosphorylation.
bacterial xenobiotic metabolite
Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
Application(s): 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).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 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 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 Sources
1-hydroxy-2,4-dinitrobenzene ChemIDplus
2,4-Dinitrophenol KEGG COMPOUND
2,4-DINITROPHENOL PDBeChem
2,4-DNP NIST Chemistry WebBook
α-dinitrophenol NIST Chemistry WebBook
Database Links Databases
2,4-Dinitrophenol Wikipedia
C02496 KEGG COMPOUND
CPD-8179 MetaCyc
DB04528 DrugBank
DNF PDBeChem
LSM-20951 LINCS
View more database links
Registry Numbers Types Sources
103005 Gmelin Registry Number Gmelin
1246142 Beilstein Registry Number Beilstein
1246142 Reaxys Registry Number Reaxys
51-28-5 CAS Registry Number ChemIDplus
51-28-5 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
10509480 PubMed citation Europe PMC
10888472 PubMed citation Europe PMC
13532746 PubMed citation Europe PMC
15307184 PubMed citation Europe PMC
16661637 PubMed citation Europe PMC
25281383 PubMed citation Europe PMC
5959282 PubMed citation Europe PMC
9129253 PubMed citation Europe PMC
Last Modified
25 February 2016