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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:17431 - agmatine
Main
ChEBI Ontology
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ChEBI Name
agmatine
ChEBI ID
CHEBI:17431
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:40556, CHEBI:2514, CHEBI:13747, CHEBI:18576
Supplier Information
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Formula
C5H14N4
Net Charge
0
Average Mass
130.19162
Monoisotopic Mass
130.12185
InChI
InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)
InChIKey
QYPPJABKJHAVHS-UHFFFAOYSA-N
SMILES
NCCCCNC(N)=N
Metabolite of Species
Details
Mus musculus
(NCBI:txid10090)
Source: BioModels - MODEL1507180067 See:
PubMed
Escherichia coli
(NCBI:txid562)
See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
Biological Role
(s):
Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in
Escherichia coli
.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
agmatine (
CHEBI:17431
)
has role
Escherichia coli
metabolite (
CHEBI:76971
)
agmatine (
CHEBI:17431
)
has role
mouse metabolite (
CHEBI:75771
)
agmatine (
CHEBI:17431
)
is a
guanidines (
CHEBI:24436
)
agmatine (
CHEBI:17431
)
is a
primary amino compound (
CHEBI:50994
)
agmatine (
CHEBI:17431
)
is conjugate base of
agmatinium(2+) (
CHEBI:58145
)
Incoming
α-allenylagmatine (
CHEBI:136807
)
has functional parent
agmatine (
CHEBI:17431
)
N
1
-aminoaminopropylagmatine (
CHEBI:64339
)
has functional parent
agmatine (
CHEBI:17431
)
N
4
-phosphoagmatine (
CHEBI:17358
)
has functional parent
agmatine (
CHEBI:17431
)
p
-coumaroylagmatine (
CHEBI:32818
)
has functional parent
agmatine (
CHEBI:17431
)
acetylagmatine (
CHEBI:2412
)
has functional parent
agmatine (
CHEBI:17431
)
agmatidine (
CHEBI:64329
)
has functional parent
agmatine (
CHEBI:17431
)
feruloylagmatine (
CHEBI:75544
)
has functional parent
agmatine (
CHEBI:17431
)
agmatinium(2+) (
CHEBI:58145
)
is conjugate acid of
agmatine (
CHEBI:17431
)
IUPAC Name
1-(4-aminobutyl)guanidine
Synonyms
Sources
(4-Aminobutyl) guanidine
KEGG COMPOUND
(4-aminobutyl)guanidine
ChEBI
Agmatine
KEGG COMPOUND
N
-(4-aminobutyl)guanidine
ChEBI
Manual Xrefs
Databases
C00001400
KNApSAcK
C00179
KEGG COMPOUND
View more database links
Registry Number
Type
Source
306-60-5
CAS Registry Number
KEGG COMPOUND
Last Modified
13 April 2018