CHEBI:57708 - benzoylagmatinium

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ChEBI Name benzoylagmatinium
ChEBI ID CHEBI:57708
Definition The conjugate acid of benzoylagmatine arising from protonation of the guanidino group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C12H19N4O
Net Charge +1
Average Mass 235.30550
Monoisotopic Mass 235.15534
InChI InChI=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
InChIKey ZRBMNUPECIGKKJ-UHFFFAOYSA-O
SMILES NC(=[NH2+])NCCCCNC(=O)c1ccccc1
ChEBI Ontology
Outgoing benzoylagmatinium (CHEBI:57708) is a guanidinium ion (CHEBI:60251)
benzoylagmatinium (CHEBI:57708) is conjugate acid of benzoylagmatine (CHEBI:16270)
Incoming benzoylagmatine (CHEBI:16270) is conjugate base of benzoylagmatinium (CHEBI:57708)
IUPAC Name
amino{[4-(benzoylamino)butyl]amino}methaniminium
Synonyms Sources
benzoylagmatinium cation ChEBI
N4-benzoylagmatine UniProt
Last Modified
13 November 2017