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CHEBI:2412 - acetylagmatine

ChEBI IDCHEBI:2412
ChEBI Nameacetylagmatine
Stars
DefinitionA member of the class of guanidines that is agmatine acetylated at the N4-position.
Last Modified23 January 2015
DownloadsMolfile
FormulaC7H16N4O
Net Charge0
Average Mass172.232
Monoisotopic Mass172.13241
SMILESCC(=O)NCCCCNC(=N)N
InChIInChI=1S/C7H16N4O/c1-6(12)10-4-2-3-5-11-7(8)9/h2-5H2,1H3,(H,10,12)(H4,8,9,11)
InChIKeyJMACEDIUUMWDIC-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
acetylagmatine (CHEBI:2412) has functional parent agmatine (CHEBI:17431)
acetylagmatine (CHEBI:2412) is a acetamide (CHEBI:27856)
acetylagmatine (CHEBI:2412) is a guanidines (CHEBI:24436)
Incoming Relation(s)
N-acetylagmatine(1+) (CHEBI:746943) is conjugate acid of acetylagmatine (CHEBI:2412)
IUPAC Name 
N-(4-carbamimidamidobutyl)acetamide
Synonyms  Source
AcetylagmatineKEGG COMPOUND
N-(4-guanidinobutyl)acetamideChEBI
[4-(acetylamino)butyl]guanidineChEBI
N-(4-{[amino(imino)methyl]amino}butyl)acetamideChEBI
Manual XrefsDatabases
C02131KEGG COMPOUND
Registry NumbersSources
Reaxys:1774242Reaxys