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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:134092 - arsenocholine
Main
ChEBI Ontology
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ChEBI Name
arsenocholine
ChEBI ID
CHEBI:134092
Definition
An arsonium ion that is choline in which the central nitrogen has been replaced by arsenic.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C5H14AsO
Net Charge
+1
Average Mass
165.086
Monoisotopic Mass
165.02551
InChI
InChI=1S/C5H14AsO/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3/q+1
InChIKey
ORLOBEXOFQEWFQ-UHFFFAOYSA-N
SMILES
[As+](CCO)(C)(C)C
Metabolite of Species
Details
Rutilus rutilus
(NCBI:txid48668)
See:
PubMed
Pandalus borealis
(NCBI:txid6703)
See:
PubMed
Homarus gammarus
(NCBI:txid6707)
See:
PubMed
Cancer pagurus
(NCBI:txid6755)
See:
PubMed
Lota lota
(NCBI:txid69944)
See:
PubMed
Clupea harengus
(NCBI:txid7950)
See:
PubMed
Esox lucius
(NCBI:txid8010)
See:
PubMed
Perca fluviatilis
(NCBI:txid8168)
See:
PubMed
Homo sapiens
(NCBI:txid9606)
Found in urine
(BTO:0001419)
. See:
PubMed
Roles Classification
Biological Role
(s):
marine metabolite
Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
xenobiotic
A xenobiotic (Greek,
xenos
"foreign";
bios
"life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
human urinary metabolite
Any metabolite (endogenous or exogenous) found in human urine samples.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
arsenocholine (
CHEBI:134092
)
has role
human urinary metabolite (
CHEBI:84087
)
arsenocholine (
CHEBI:134092
)
has role
marine metabolite (
CHEBI:76507
)
arsenocholine (
CHEBI:134092
)
has role
xenobiotic (
CHEBI:35703
)
arsenocholine (
CHEBI:134092
)
is a
arsonium ion (
CHEBI:62607
)
arsenocholine (
CHEBI:134092
)
is a
organoarsenic compound (
CHEBI:33406
)
IUPAC Name
(2-hydroxyethyl)(trimethyl)arsanium
Synonym
Source
(2-Hydroxyethyl)trimethylarsonium
ChemIDplus
Manual Xref
Database
HMDB0032683
HMDB
View more database links
Registry Numbers
Types
Sources
1736750
Reaxys Registry Number
Reaxys
39895-81-3
CAS Registry Number
ChemIDplus
Citations
Types
Sources
1580419
PubMed citation
Europe PMC
16746711
PubMed citation
Europe PMC
2363511
PubMed citation
Europe PMC
27277209
PubMed citation
Europe PMC
2953397
PubMed citation
Europe PMC
3288685
PubMed citation
Europe PMC
3349210
PubMed citation
Europe PMC
3435795
PubMed citation
Europe PMC
6642710
PubMed citation
Europe PMC
6719099
PubMed citation
Europe PMC
IND86035749
Agricola citation
Europe PMC
IND92025878
Agricola citation
Europe PMC
Last Modified
09 December 2016