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CHEBI:58042 - guanidinoethyl methyl phosphate zwitterion

ChEBI IDCHEBI:58042
ChEBI Nameguanidinoethyl methyl phosphate zwitterion
Stars
DefinitionZwitterionic form of guanidinoethyl methyl phosphate arising from transfer of a proton from the phospho to the guanidino group; major species at pH 7.3.
Last Modified13 November 2017
DownloadsMolfile
FormulaC4H12N3O4P
Net Charge0
Average Mass197.131
Monoisotopic Mass197.05654
SMILESCOP(=O)([O-])OCCNC(N)=[NH2+]
InChIInChI=1S/C4H12N3O4P/c1-10-12(8,9)11-3-2-7-4(5)6/h2-3H2,1H3,(H,8,9)(H4,5,6,7)
InChIKeyPTALSLHNZQRENZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
guanidinoethyl methyl phosphate zwitterion (CHEBI:58042) is a zwitterion (CHEBI:27369)
guanidinoethyl methyl phosphate zwitterion (CHEBI:58042) is tautomer of guanidinoethyl methyl phosphate (CHEBI:17175)
Incoming Relation(s)
guanidinoethyl methyl phosphate (CHEBI:17175) is tautomer of guanidinoethyl methyl phosphate zwitterion (CHEBI:58042)
IUPAC Name 
2-{[amino(iminio)methyl]amino}ethyl methyl phosphate
UniProt Name  Source
guanidinoethyl methyl phosphateUniProt