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Chemical Entities of Biological Interest Ontology
Last uploaded:
December 1, 2024
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| Preferred Name | safinamide | |
| Synonyms |
safinamide methanesulfonate EMD 1195686 xadago safinamide mesilate EMD-1195686 safinamide mesylate |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_134718 |
|
| charge |
0
|
|
| database_cross_reference |
Drug_Central:4921 CAS:133865-89-1
|
|
| formula |
C17H19FN2O2
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
safinamide methanesulfonate EMD 1195686 xadago safinamide mesilate EMD-1195686 safinamide mesylate
|
|
| id |
CHEBI:134718
|
|
| in_subset | ||
| inchi |
InChI=1S/C17H19FN2O2/c1-12(17(19)21)20-10-13-5-7-16(8-6-13)22-11-14-3-2-4-15(18)9-14/h2-9,12,20H,10-11H2,1H3,(H2,19,21)/t12-/m0/s1
|
|
| inchikey |
NEMGRZFTLSKBAP-LBPRGKRZSA-N
|
|
| label |
safinamide
|
|
| mass |
302.344
|
|
| monoisotopicmass |
302.14306
|
|
| notation |
CHEBI:134718
|
|
| prefLabel |
safinamide
|
|
| smiles |
C1=CC=C(C=C1COC=2C=CC(=CC2)CN[C@H](C(N)=O)C)F
|
|
| treeView | ||
| subClassOf |
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