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Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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The Swiss Initiative in Systems Biology

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nitrobenzene

Properties

Image

Occurences in reactions

MNX_ID

MNXM5853

Image of MNXM5853

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	1

formula

C₆H₅NO₂

charge

0

mass

123.03203

reference

InChIKey

LQNUZADURLCDLV-UHFFFAOYSA-N

InChI

InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H

SMILES

O=[N+]([O-])c1ccccc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27798 chebi:27798	nitrobenzene NITROBENZENE Nitrobenzene Nitrobenzol oil of mirbane
envipath:...3f729842f7c3 envipathM:...3f729842f7c3	Nitrobenzene
hmdb:HMDB0041950	Nitrobenzene 4-Hydroxynitrobenzene 4-Nitrophenol Essence OF mirbane Essence OF myrbane Hydroxy(phenyl)azane oxide (acd/name 4.0) Mirbane oil Niphen Nitro-benzene Nitrobenzeen Nitrobenzen Nitrobenzol Nitrobenzol, liquid(dot) Oil OF mirbane Oil OF myrbane PNP PNP, p-Nitrophenol Rcra waste number u169 nitrobenzene p-Nitrophenol
sabiork.compound:8939 sabiorkM:8939 kegg.compound:C06813 keggC:C06813	Nitrobenzene Nitrobenzol
seed.compound:cpd04184 seedM:cpd04184	Nitrobenzol Nitrobenzene benzene-NO2 nitro-benzene nitrobenzene
envipath:...6b0e06447bff envipathM:...6b0e06447bff	compound 0051370
metacyc.compound:BENZENE-NO2 metacycM:BENZENE-NO2	nitrobenzene benzene-NO2 nitro-benzene
hmdb:HMDB41950 chebi:116696 chebi:25551 chebi:44199 chebi:7588 keggC:M_C06813 seedM:M_cpd04184	secondary/obsolete/fantasy identifier