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

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4-nitroanisole

	Properties	Image
MNX_ID	MNXM37660
reference	chebi:1911
formula	C₇H₇NO₃
global charge	0
mol weight	153.137
InChIKey	BNUHAJGCKIQFGE-UHFFFAOYSA-N
InChI	InChI=1S/C7H7NO3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3
SMILES	COC1=CC=C([N+](=O)[O-])C=C1

MNX internals

InChI (mnx)	InChI=1/C7H7NO3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3
SMILES (mnx)	[CH3:1][O:11][C:7]1=[CH:5][CH:3]=[C:6]([N+:8]([O-:9])=[O:10])[CH:2]=[CH:4]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:1911 chebi:1911 BNUHAJGCKIQFGE-UHFFFAOYSA-N	4-nitroanisole 1-methoxy-4-nitrobenzene 4-Methoxynitrobenzene 4-Nitroanisole 4-Nitrophenyl methyl ether p-Methoxynitrobenzene p-Nitroanisole
hmdb:HMDB0246530 BNUHAJGCKIQFGE-UHFFFAOYSA-N	4-Nitroanisole 1-methoxy-4-nitrobenzene 4-Methoxynitrobenzene 4-Nitrophenyl methyl ether Para-nitroanisole nitroanisole p-Methoxynitrobenzene p-Nitroanisole
kegg.compound:C07555 keggC:C07555 BNUHAJGCKIQFGE-UHFFFAOYSA-N	4-Nitroanisole p-Nitroanisole
metacyc.compound:CPD-17561 metacycM:CPD-17561 BNUHAJGCKIQFGE-UHFFFAOYSA-N	4-nitroanisole 4-methoxynitrobenzene 4-nitrophenyl methyl ether p-methoxynitrobenzene p-nitroanisole
seed.compound:cpd04725 seedM:cpd04725 BNUHAJGCKIQFGE-UHFFFAOYSA-N	p-Nitroanisole 4-Nitroanisole 4-methoxynitrobenzene 4-nitroanisole 4-nitrophenyl methyl ether p-methoxynitrobenzene p-nitroanisole
keggC:M_C07555 seedM:M_cpd04725	secondary/obsolete/fantasy identifier