Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:2412 - acetylagmatine
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
acetylagmatine
ChEBI ID
CHEBI:2412
Definition
A member of the class of guanidines that is agmatine acetylated at the N4-position.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C7H16N4O
Net Charge
0
Average Mass
172.22830
Monoisotopic Mass
172.13241
InChI
InChI=1S/C7H16N4O/c1-6(12)10-4-2-3-5-11-7(8)9/h2-5H2,1H3,(H,10,12)(H4,8,9,11)
InChIKey
JMACEDIUUMWDIC-UHFFFAOYSA-N
SMILES
CC(=O)NCCCCNC(N)=N
ChEBI Ontology
Outgoing
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
)
IUPAC Name
N
-(4-carbamimidamidobutyl)acetamide
Synonyms
Sources
[4-(acetylamino)butyl]guanidine
ChEBI
Acetylagmatine
KEGG COMPOUND
N
-(4-guanidinobutyl)acetamide
ChEBI
N
-(4-{[amino(imino)methyl]amino}butyl)acetamide
ChEBI
Manual Xref
Database
C02131
KEGG COMPOUND
View more database links
Registry Number
Type
Source
1774242
Reaxys Registry Number
Reaxys
Last Modified
23 January 2015