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CHEBI:58599 - N'-phosphonatoguanidinoethyl methyl phosphate(2−)

ChEBI IDCHEBI:58599
ChEBI NameN'-phosphonatoguanidinoethyl methyl phosphate(2−)
Stars
ASCII NameN'-phosphonatoguanidinoethyl methyl phosphate(2-)
DefinitionDianion of N'-phosphoguanidinoethyl methyl phosphate.
Last Modified13 November 2017
DownloadsMolfile
FormulaC4H11N3O7P2
Net Charge-2
Average Mass275.094
Monoisotopic Mass275.00832
SMILESCOP(=O)([O-])OCCNC(=[NH2+])NP(=O)([O-])[O-]
InChIInChI=1S/C4H13N3O7P2/c1-13-16(11,12)14-3-2-6-4(5)7-15(8,9)10/h2-3H2,1H3,(H,11,12)(H5,5,6,7,8,9,10)/p-2
InChIKeySKVVAASQKFJYKN-UHFFFAOYSA-L
ChEBI Ontology
Outgoing Relation(s)
N'-phosphonatoguanidinoethyl methyl phosphate(2−) (CHEBI:58599) is a organophosphate oxoanion (CHEBI:58945)
N'-phosphonatoguanidinoethyl methyl phosphate(2−) (CHEBI:58599) is conjugate base of N'-phosphoguanidinoethyl methyl hydrogen phosphate (CHEBI:28968)
Incoming Relation(s)
N'-phosphoguanidinoethyl methyl hydrogen phosphate (CHEBI:28968) is conjugate acid of N'-phosphonatoguanidinoethyl methyl phosphate(2−) (CHEBI:58599)
IUPAC Name 
2-{[iminio(phosphonatoamino)methyl]amino}ethyl methyl phosphate
UniProt Name  Source
N'-phosphoguanidinoethyl methylphosphateUniProt