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

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5-ureidoimidazole-4-carboxylic acid

	Properties	Image
MNX_ID	MNXM4401
reference	chebi:27580
formula	C₅H₆N₄O₃
global charge	0
mol weight	170.128
InChIKey	PQSKWIHIUOGLHX-UHFFFAOYSA-N
InChI	InChI=1S/C5H6N4O3/c6-5(12)9-3-2(4(10)11)7-1-8-3/h1H,(H,7,8)(H,10,11)(H3,6,9,12)
SMILES	NC(=O)NC1=C(C(=O)O)N=CN1

MNX internals

InChI (mnx)	InChI=1/C5H6N4O3/c6-5(12)9-3-2(4(10)11)7-1-8-3/h1H,(H,7,8)(H,10,11)(H3,6,9,12)
SMILES (mnx)	[CH:1]1=[N:7][C:2]([C:4](=[O:10])[OH:11])=[C:3]([NH:9][C:5](=[NH:6])[OH:12])[NH:8]1

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:27580 chebi:27580 PQSKWIHIUOGLHX-UHFFFAOYSA-N	5-ureidoimidazole-4-carboxylic acid 4-Ureido-5-imidazolecarboxylic acid 5-(carbamoylamino)-1H-imidazole-4-carboxylic acid 5-Ureido-4-imidazole carboxylate
vmhM:5ud4imdzcxl vmhmetabolite:5ud4imdzcxl PQSKWIHIUOGLHX-UHFFFAOYSA-N	5-Ureido-4-imidazole carboxylate
kegg.compound:C05515 keggC:C05515 PQSKWIHIUOGLHX-UHFFFAOYSA-N	5-Ureido-4-imidazole carboxylate 4-Ureido-5-imidazolecarboxylic acid
seed.compound:cpd03280 seedM:cpd03280 PQSKWIHIUOGLHX-UHFFFAOYSA-M	5-Ureido-4-imidazole carboxylate 4-Ureido-5-imidazolecarboxylic acid 4-ureido-5-imidazole carboxylate 5-(carbamoylamino)-1H-imidazole-4-carboxylate 5-ureidoimidazole-4-carboxylate
metacyc.compound:5-UREIDO-4-IMIDAZOLE_CARBOXYLATE metacycM:5-UREIDO-4-IMIDAZOLE_CARBOXYLATE PQSKWIHIUOGLHX-UHFFFAOYSA-M	5-ureidoimidazole-4-carboxylate 5-(carbamoylamino)-1H-imidazole-4-carboxylate
chebi:20631 chebi:2126 keggC:M_C05515 seedM:M_cpd03280 vmhM:M_5ud4imdzcxl	secondary/obsolete/fantasy identifier