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loading...| 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 |
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| 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 |
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