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

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benzene

	Properties	Image
MNX_ID	MNXM1651
reference	chebi:16716
formula	C₆H₆
global charge	0
mol weight	78.114
InChIKey	UHOVQNZJYSORNB-UHFFFAOYSA-N
InChI	InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
SMILES	C1=CC=CC=C1

MNX internals

InChI (mnx)	InChI=1/C6H6/c1-2-4-6-5-3-1/h1-6H
SMILES (mnx)	[CH:1]1=[CH:2][CH:4]=[CH:6][CH:5]=[CH:3]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	7
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
reactome:R-ALL-31711 reactomeM:R-ALL-31711 CHEBI:16716 chebi:16716 UHOVQNZJYSORNB-UHFFFAOYSA-N	benzene BENZENE Benzen Benzene Benzine Benzol Bicarburet of hydrogen Coal naphtha Mineral naphtha Phene Pyrobenzol Pyrobenzole [6]annulene benzole cyclohexatriene phenyl hydride
envipath:...e5e01da33af6 envipathM:...e5e01da33af6 envipath:...113409b89c26 envipathM:...113409b89c26 kegg.compound:C01407 keggC:C01407 UHOVQNZJYSORNB-UHFFFAOYSA-N	Benzene
hmdb:HMDB0001505 UHOVQNZJYSORNB-UHFFFAOYSA-N	Benzene (6)Annulene Annulene Aromatic alkane BNZ Benzeen Benzen Benzin Benzine Benzinum Benzol Benzol 90 Benzole Benzolene Benzolo Benzolum Bicarburet OF hydrogen Carbon oil Coal naphtha Cyclohexatriene Fenzen Mineral naphtha Motor benzol Phene Phenyl hydride Polystream Pyrobenzol Pyrobenzole RNG [6]Annulene benzene {[6]annulene}
seed.compound:cpd01007 seedM:cpd01007 UHOVQNZJYSORNB-UHFFFAOYSA-N	Benzene Aromatic alkane benzene benzol benzole
sabiork.compound:27728 sabiorkM:27728 UHOVQNZJYSORNB-UHFFFAOYSA-N	Benzol
CHEBI:193039 chebi:193039 UHOVQNZJYSORNB-UHFFFAOYSA-N	benzene-d6 ((2)H6)benzene 1,2,3,4,5,6-hexadeuteriobenzene Benzol-d6 benzene-1,2,3,4,5,6-d6 hexadeuterobenzene perdeuterobenzene
metacyc.compound:BENZENE metacycM:BENZENE UHOVQNZJYSORNB-UHFFFAOYSA-N	benzene benzol benzole
envipath:...fa654a44fc8a envipathM:...fa654a44fc8a UHOVQNZJYSORNB-UHFFFAOYSA-N	compound 0000133
hmdb:HMDB01505 chebi:13876 chebi:22703 chebi:3025 chebi:41187 keggC:M_C01407 seedM:M_cpd01007	secondary/obsolete/fantasy identifier