CHEBI:58644 - p-coumaroylagmatine(1+)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name p-coumaroylagmatine(1+)
ChEBI ID CHEBI:58644
ChEBI ASCII Name p-coumaroylagmatine(1+)
Definition A guanidinium ion obtained by protonation of the imino nitrogen of N-(4-guanidinobutyl)-4-hydroxycinnamamide.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C14H21N4O2
Net Charge +1
Average Mass 277.34160
Monoisotopic Mass 277.16590
InChI InChI=1S/C14H20N4O2/c15-14(16)18-10-2-1-9-17-13(20)8-5-11-3-6-12(19)7-4-11/h3-8,19H,1-2,9-10H2,(H,17,20)(H4,15,16,18)/p+1
InChIKey AKIHYQWCLCDMMI-UHFFFAOYSA-O
SMILES NC(=[NH2+])NCCCCNC(=O)C=Cc1ccc(O)cc1
ChEBI Ontology
Outgoing p-coumaroylagmatine(1+) (CHEBI:58644) is a guanidinium ion (CHEBI:60251)
p-coumaroylagmatine(1+) (CHEBI:58644) is conjugate base of p-coumaroylagmatine (CHEBI:32818)
Incoming (E)-p-coumaroylagmatine(1+) (CHEBI:86078) is a p-coumaroylagmatine(1+) (CHEBI:58644)
(Z)-p-coumaroylagmatine(1+) (CHEBI:86083) is a p-coumaroylagmatine(1+) (CHEBI:58644)
p-coumaroylagmatine (CHEBI:32818) is conjugate acid of p-coumaroylagmatine(1+) (CHEBI:58644)
IUPAC Name
amino[(4-{[3-(4-hydroxyphenyl)acryloyl]amino}butyl)amino]methaniminium
Synonym Source
N-(4-guanidinobutyl)-4-hydroxycinnamamide UniProt
Last Modified
18 June 2015