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Chemical Entities of Biological Interest Ontology
Last uploaded:
December 1, 2024
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| Preferred Name | frovatriptan | |
| Synonyms |
frovatriptan succinate SB 209509 frovatriptan succinate hydrate (R)-Frovatriptan VML251 |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_134991 |
|
| charge |
0
|
|
| database_cross_reference |
CAS:158747-02-5 HMDB:HMDB0015133 Drug_Central:1251
|
|
| formula |
C14H17N3O
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
frovatriptan succinate SB 209509 frovatriptan succinate hydrate (R)-Frovatriptan VML251
|
|
| id |
CHEBI:134991
|
|
| in_subset | ||
| inchi |
InChI=1S/C14H17N3O/c1-16-9-3-5-13-11(7-9)10-6-8(14(15)18)2-4-12(10)17-13/h2,4,6,9,16-17H,3,5,7H2,1H3,(H2,15,18)/t9-/m1/s1
|
|
| inchikey |
XPSQPHWEGNHMSK-SECBINFHSA-N
|
|
| label |
frovatriptan
|
|
| mass |
243.305
|
|
| monoisotopicmass |
243.13716
|
|
| notation |
CHEBI:134991
|
|
| prefLabel |
frovatriptan
|
|
| smiles |
C(N)(=O)C=1C=C2C3=C(NC2=CC1)CC[C@H](C3)NC
|
|
| treeView | ||
| subClassOf |
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