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CHEBI:17536 - allantoate

ChEBI IDCHEBI:17536
ChEBI Nameallantoate
Stars
DefinitionA monocarboxylic acid anion that is the conjugate base of allantoic acid.
Secondary ChEBI IDsCHEBI:13760, CHEBI:22352, CHEBI:39599
Last Modified12 January 2024
DownloadsMolfile
FormulaC4H7N4O4
Net Charge-1
Average Mass175.124
Monoisotopic Mass175.04728
SMILESNC(=O)NC(NC(N)=O)C(=O)[O-]
InChIInChI=1S/C4H8N4O4/c5-3(11)7-1(2(9)10)8-4(6)12/h1H,(H,9,10)(H3,5,7,11)(H3,6,8,12)/p-1
InChIKeyNUCLJNSWZCHRKL-UHFFFAOYSA-M
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
allantoate (CHEBI:17536) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
allantoate (CHEBI:17536) has role human metabolite (CHEBI:77746)
allantoate (CHEBI:17536) is a monocarboxylic acid anion (CHEBI:35757)
allantoate (CHEBI:17536) is a ureas (CHEBI:47857)
allantoate (CHEBI:17536) is conjugate base of allantoic acid (CHEBI:30837)
Incoming Relation(s)
allantoic acid (CHEBI:30837) is conjugate acid of allantoate (CHEBI:17536)
IUPAC Name 
bis(carbamoylamino)acetate
Synonyms  Source
2,2-bis(aminocarbonylamino)ethanoatePDBeChem
allantoate ionPDBeChem
bis[(aminocarbonyl)amino]acetateChEBI
bis(carbamoylamino)acetatePDBeChem
diureidoacetateChEBI
UniProt Name  Source
allantoateUniProt
Manual XrefsDatabases
1ALPDBeChem
ALLANTOATEMetaCyc
C00499KEGG COMPOUND