Preferred Name |
neostigmine methyl sulfate |
|
Synonyms |
Prostigmin (TN) Neostigmine methylsulfate |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_7516 |
|
charge |
0 |
|
database_cross_reference |
KEGG:D00998 KEGG:C08200 CAS:51-60-5 |
|
formula |
C12H19N2O2.CH3O4S |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
Prostigmin (TN) Neostigmine methylsulfate |
|
id |
CHEBI:7516 |
|
in_subset | ||
inchi |
InChI=1S/C12H19N2O2.CH4O4S/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;1-5-6(2,3)4/h6-9H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1 |
|
inchikey |
OSZNNLWOYWAHSS-UHFFFAOYSA-M |
|
label |
neostigmine methyl sulfate |
|
mass |
334.390 |
|
monoisotopicmass |
334.11986 |
|
notation |
CHEBI:7516 |
|
prefLabel |
neostigmine methyl sulfate |
|
RO_0000087 | ||
smiles |
COS([O-])(=O)=O.CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C |
|
subClassOf |
Create mapping