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CHEBI:57708 - benzoylagmatinium

ChEBI IDCHEBI:57708
ChEBI Namebenzoylagmatinium
Stars
DefinitionThe conjugate acid of benzoylagmatine arising from protonation of the guanidino group; major species at pH 7.3.
Last Modified13 November 2017
DownloadsMolfile
FormulaC12H19N4O
Net Charge+1
Average Mass235.311
Monoisotopic Mass235.15534
SMILESNC(=[NH2+])NCCCCNC(=O)c1ccccc1
InChIInChI=1S/C12H18N4O/c13-12(14)16-9-5-4-8-15-11(17)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,15,17)(H4,13,14,16)/p+1
InChIKeyZRBMNUPECIGKKJ-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
benzoylagmatinium (CHEBI:57708) is a guanidinium ion (CHEBI:60251)
benzoylagmatinium (CHEBI:57708) is conjugate acid of benzoylagmatine (CHEBI:16270)
Incoming Relation(s)
benzoylagmatine (CHEBI:16270) is conjugate base of benzoylagmatinium (CHEBI:57708)
IUPAC Name 
amino{[4-(benzoylamino)butyl]amino}methaniminium
Synonym  Source
benzoylagmatinium cationChEBI
UniProt Name  Source
N4-benzoylagmatineUniProt