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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:17443 -
L
-homocitrulline
Main
ChEBI Ontology
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ChEBI Name
L
-homocitrulline
ChEBI ID
CHEBI:17443
ChEBI ASCII Name
L-homocitrulline
Definition
A
L
-lysine derivative that is
L
-lysine having a carbamoyl group at the
N
6
-position. It is found in individuals with urea cycle disorders.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:13121, CHEBI:6244, CHEBI:21328
Supplier Information
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Formula
C7H15N3O3
Net Charge
0
Average Mass
189.21242
Monoisotopic Mass
189.11134
InChI
InChI=1S/C7H15N3O3/c8-5(6(11)12)3-1-2-4-10-7(9)13/h5H,1-4,8H2,(H,11,12)(H3,9,10,13)/t5-/m0/s1
InChIKey
XIGSAGMEBXLVJJ-YFKPBYRVSA-N
SMILES
N[C@@H](CCCCNC(N)=O)C(O)=O
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
)
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Biological Role
(s):
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (
Mus musculus
).
human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (
Homo sapiens
).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
L
-homocitrulline (
CHEBI:17443
)
has role
human metabolite (
CHEBI:77746
)
L
-homocitrulline (
CHEBI:17443
)
has role
mouse metabolite (
CHEBI:75771
)
L
-homocitrulline (
CHEBI:17443
)
is a
L
-lysine derivative (
CHEBI:25095
)
L
-homocitrulline (
CHEBI:17443
)
is a
non-proteinogenic
L
-α-amino acid (
CHEBI:83822
)
L
-homocitrulline (
CHEBI:17443
)
is a
ureas (
CHEBI:47857
)
L
-homocitrulline (
CHEBI:17443
)
is tautomer of
L
-homocitrulline zwitterion (
CHEBI:58148
)
Incoming
L
-homocitrulline residue (
CHEBI:144369
)
is substituent group from
L
-homocitrulline (
CHEBI:17443
)
L
-homocitrulline zwitterion (
CHEBI:58148
)
is tautomer of
L
-homocitrulline (
CHEBI:17443
)
IUPAC Names
(2
S
)-2-amino-6-(carbamoylamino)hexanoic acid
N
6
-carbamoyl-
L
-lysine
Synonyms
Sources
L-Homocitrulline
KEGG COMPOUND
N(6)-(aminocarbonyl)-L-lysine
ChemIDplus
Manual Xrefs
Databases
C02427
KEGG COMPOUND
CPD-161
MetaCyc
HMDB0000679
HMDB
View more database links
Registry Numbers
Types
Sources
1190-49-4
CAS Registry Number
KEGG COMPOUND
1190-49-4
CAS Registry Number
ChemIDplus
1726129
Reaxys Registry Number
Reaxys
Citations
Types
Sources
2432665
PubMed citation
Europe PMC
2474087
PubMed citation
Europe PMC
518684
PubMed citation
Europe PMC
6821687
PubMed citation
Europe PMC
901434
PubMed citation
Europe PMC
901435
PubMed citation
Europe PMC
Last Modified
16 September 2019