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

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pyrimidine

	Properties	Image
MNX_ID	MNXM1094080
reference	chebi:16898
formula	C₄H₄N₂
global charge	0
mol weight	80.09
InChIKey	CZPWVGJYEJSRLH-UHFFFAOYSA-N
InChI	InChI=1S/C4H4N2/c1-2-5-4-6-3-1/h1-4H
SMILES	C1=CN=CN=C1

MNX internals

InChI (mnx)	InChI=1/C4H4N2/c1-2-5-4-6-3-1/h1-4H
SMILES (mnx)	[CH:1]1=[CH:2][N:5]=[CH:4][N:6]=[CH:3]1

Parent-child relations graph

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

Similar chemical compounds in external resources
Identifier	Description
CHEBI:16898 chebi:16898 CZPWVGJYEJSRLH-UHFFFAOYSA-N	pyrimidine 1,3-Diazin 1,3-Diazine Metadiazine PYRIMIDINE Pyrimidin Pyrimidine Pyrimidine base m-diazine
bigg.metabolite:pyrimid biggM:pyrimid vmhM:pyrimid vmhmetabolite:pyrimid CZPWVGJYEJSRLH-UHFFFAOYSA-N	Pyrimidine
vmhM:pyrin vmhmetabolite:pyrin CZPWVGJYEJSRLH-UHFFFAOYSA-N	Pyrimidine_nucleoside
seed.compound:cpd28006 seedM:cpd28006 CZPWVGJYEJSRLH-UHFFFAOYSA-N	Pyrimidines
hmdb:HMDB0003361 CZPWVGJYEJSRLH-UHFFFAOYSA-N	Pyrimidine 1,3-Diazabenzene 1,3-Diazin 1,3-Diazine Metadiazine Miazine PY PYR Pyrimidin Pyrimidine base Pyrimidine dimer m-Diazine pyrimidine
seed.compound:cpd00316 seedM:cpd00316 kegg.compound:C00396 keggC:C00396 CZPWVGJYEJSRLH-UHFFFAOYSA-N	Pyrimidine Pyrimidine base
metacyc.compound:Pyrimidines metacycM:Pyrimidines CZPWVGJYEJSRLH-UHFFFAOYSA-N	a pyrimidine a pyrimidine-related compound
seed.compound:cpd27827 seedM:cpd27827 CZPWVGJYEJSRLH-UHFFFAOYSA-N	pyrimidine-ring 1,3-diazin m-diazine metadiazine pyrimidine
metacyc.compound:PYRIMIDINE-RING metacycM:PYRIMIDINE-RING CZPWVGJYEJSRLH-UHFFFAOYSA-N	pyrimidine 1,3-diazin m-diazine metadiazine
hmdb:HMDB03361 chebi:14982 chebi:44847 chebi:8675 biggM:M_pyrimid keggC:M_C00396 seedM:M_cpd00316 seedM:M_cpd27827 seedM:M_cpd28006 vmhM:M_pyrimid vmhM:M_pyrin	secondary/obsolete/fantasy identifier