EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:132481 - guanidine acetate

Default Structure
ChEBI IDCHEBI:132481
ChEBI Nameguanidine acetate
Stars
DefinitionAn organic salt obtained by combining guanidine with one molar equivalent of acetic acid.
Last Modified16 January 2017
SubmitterKeeva
DownloadsMolfile
FormulaC2H4O2.CH5N3
Net Charge0
Average Mass119.124
Monoisotopic Mass119.06948
SMILESCC(=O)O.N=C(N)N
InChIInChI=1S/C2H4O2.CH5N3/c1-2(3)4;2-1(3)4/h1H3,(H,3,4);(H5,2,3,4)
InChIKeyDXTIKTAIYCJTII-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - MetaboLights (MTBLS292)
ChEBI Ontology
Outgoing Relation(s)
guanidine acetate (CHEBI:132481) has part acetate (CHEBI:30089)
guanidine acetate (CHEBI:132481) has part guanidinium (CHEBI:30087)
guanidine acetate (CHEBI:132481) is a organic salt (CHEBI:24868)
IUPAC Names 
acetic acid—guanidine (1/1)
amino(imino)methanaminium acetate
Synonyms  Source
Guanidine, acetate (1:1)ChemIDplus
Guanidine monoacetateChemIDplus
guanidinium acetateChEBI
guanidinium monoacetateChEBI
Manual XrefsDatabases
451377ChemSpider
Registry NumbersSources
Reaxys:3565247Reaxys
CAS:593-87-3ChemIDplus