Carbadox (CHEBI:174442)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Carbadox

ChEBI ID	CHEBI:174442

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C11H10N4O4

Net Charge

Average Mass

262.225

Monoisotopic Mass

262.07020

InChI

InChI=1S/C11H10N4O4/c1-19-11(16)13-12-6-8-7-14(17)9-4-2-3-5-10(9)15(8)18/h2-7H,1H3,(H,13,16)/b12-6+

InChIKey

OVGGLBAWFMIPPY-WUXMJOGZSA-N

SMILES

[O-][N+]=1C=2C([N+]([O-])=CC1\C=N\NC(OC)=O)=CC=CC2

ChEBI Ontology
Outgoing	Carbadox (CHEBI:174442) is a quinoxaline derivative (CHEBI:38771)

IUPAC Name

methyl N-[(E)-(1,4-dioxidoquinoxaline-1,4-diium-2-yl)methylideneamino]carbamate