Preferred Name |
neostigmine |
|
Synonyms |
3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium m-Trimethylammoniumphenyldimethylcarbamate Vagostigmine Prostigmine (m-Hydroxyphenyl)trimethylammonium dimethylcarbamate 3-Trimethylammoniumphenyl N,N-dimethylcarbamate Eustigmin Eustigmine |
|
Definitions |
A quaternary ammonium ion comprising an anilinium ion core having three methyl substituents on the aniline nitrogen, and a 3-[(dimethylcarbamoyl)oxy] substituent at position 3. It is a parasympathomimetic which acts as a reversible acetylcholinesterase inhibitor. |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_7514 |
|
charge |
+1 |
|
database_cross_reference |
LINCS:LSM-5360 DrugBank:DB01400 Wikipedia:Neostigmine Reaxys:3615946 Beilstein:3615946 PMID:8584207 KEGG:D08261 Drug_Central:1897 HMDB:HMDB0015472 KEGG:C07258 CAS:59-99-4 PMID:7200780 |
|
definition |
A quaternary ammonium ion comprising an anilinium ion core having three methyl substituents on the aniline nitrogen, and a 3-[(dimethylcarbamoyl)oxy] substituent at position 3. It is a parasympathomimetic which acts as a reversible acetylcholinesterase inhibitor. |
|
formula |
C12H19N2O2 |
|
has role | ||
has_exact_synonym |
3-[(dimethylcarbamoyl)oxy]-N,N,N-trimethylanilinium |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
m-Trimethylammoniumphenyldimethylcarbamate Vagostigmine Prostigmine (m-Hydroxyphenyl)trimethylammonium dimethylcarbamate 3-Trimethylammoniumphenyl N,N-dimethylcarbamate Eustigmin Eustigmine |
|
has_RxCUI |
7315 |
|
id |
CHEBI:7514 |
|
in_subset | ||
inchi |
InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1 |
|
inchikey |
ALWKGYPQUAPLQC-UHFFFAOYSA-N |
|
label |
neostigmine Neostigmine |
|
mass |
223.29150 |
|
monoisotopicmass |
223.14410 |
|
notation |
CHEBI:7514 |
|
prefLabel |
neostigmine |
|
smiles |
CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C |
|
subClassOf |