CHEBI:32818 - p-coumaroylagmatine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name p-coumaroylagmatine
ChEBI ID CHEBI:32818
ChEBI ASCII Name p-coumaroylagmatine
Definition A member of the class of cinnamamides obtained by formal condensation of the carboxy group of 4-coumaric acid with the primary amino group of agmatine.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:28605, CHEBI:21469, CHEBI:7089, CHEBI:12430, CHEBI:21470
Supplier Information
Download Molfile XML SDF
Formula C14H20N4O2
Net Charge 0
Average Mass 276.33420
Monoisotopic Mass 276.15863
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)
InChIKey AKIHYQWCLCDMMI-UHFFFAOYSA-N
SMILES NC(=N)NCCCCNC(=O)C=Cc1ccc(O)cc1
ChEBI Ontology
Outgoing p-coumaroylagmatine (CHEBI:32818) has functional parent 4-coumaric acid (CHEBI:36090)
p-coumaroylagmatine (CHEBI:32818) has functional parent agmatine (CHEBI:17431)
p-coumaroylagmatine (CHEBI:32818) is a cinnamamides (CHEBI:23247)
p-coumaroylagmatine (CHEBI:32818) is a guanidines (CHEBI:24436)
p-coumaroylagmatine (CHEBI:32818) is a phenols (CHEBI:33853)
p-coumaroylagmatine (CHEBI:32818) is conjugate acid of p-coumaroylagmatine(1+) (CHEBI:58644)
Incoming hordatine A (CHEBI:5762) has functional parent p-coumaroylagmatine (CHEBI:32818)
hordatine B (CHEBI:5763) has functional parent p-coumaroylagmatine (CHEBI:32818)
(E)-p-coumaroylagmatine (CHEBI:86080) is a p-coumaroylagmatine (CHEBI:32818)
(Z)-p-coumaroylagmatine (CHEBI:86085) is a p-coumaroylagmatine (CHEBI:32818)
p-coumaroylagmatine(1+) (CHEBI:58644) is conjugate base of p-coumaroylagmatine (CHEBI:32818)
IUPAC Name
N-[4-(carbamimidamido)butyl]-3-(4-hydroxyphenyl)prop-2-enamide
Synonyms Sources
coumaroylagmatine ChEBI
N-(4-guanidinobutyl)-4-hydroxycinnamamide ChEBI
N-(4-Guanidinobutyl)-4-hydroxycinnamamide KEGG COMPOUND
N-(4-Guanidinobutyl)-4-hydroxycinnamide KEGG COMPOUND
N-(4-guanidinobutyl)-p-hydroxycinnamamide ChEBI
Manual Xrefs Databases
C04498 KEGG COMPOUND
HMDB0033460 HMDB
N-4-GUANIDINOBUTYL-4-HYDROXYCINNAMAMID MetaCyc
View more database links
Registry Numbers Types Sources
2658799 Beilstein Registry Number Beilstein
2658799 Reaxys Registry Number Reaxys
7295-86-5 CAS Registry Number HMDB
Last Modified
18 June 2015