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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
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| Preferred Name | almotriptan malate | |
| Synonyms |
C17H25N3O2S.C4H6O5 C21H31N3O7S 1-(((3-(2-(Dimethylamino)ethyl)-1H-indol-5-yl)methyl)sulfonyl)pyrrolidine hydroxybutanedioate 1-(((3-(2-(Dimethylamino)ethyl)indol-5-yl)methyl)sulfonyl)pyrrolidine malate |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_53781 |
|
| Definition |
The malate salt of almotriptan.
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|
| has role |
http://purl.obolibrary.org/obo/CHEBI_35941 |
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| InChI |
InChI=1S/C17H25N3O2S.C4H6O5/c1-19(2)10-7-15-12-18-17-6-5-14(11-16(15)17)13-23(21,22)20-8-3-4-9-20;5-2(4(8)9)1-3(6)7/h5-6,11-12,18H,3-4,7-10,13H2,1-2H3;2,5H,1H2,(H,6,7)(H,8,9)
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| InChIKey |
InChIKey=QHATUKWEVNMHRY-UHFFFAOYSA-N
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|
| label |
almotriptan malate
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|
| prefixIRI |
obo2:CHEBI_53781
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|
| prefLabel |
almotriptan malate
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|
| SMILES |
OC(CC(O)=O)C(O)=O.CN(C)CCc1c[nH]c2ccc(CS(=O)(=O)N3CCCC3)cc12
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|
| Synonym |
C17H25N3O2S.C4H6O5 C21H31N3O7S 1-(((3-(2-(Dimethylamino)ethyl)-1H-indol-5-yl)methyl)sulfonyl)pyrrolidine hydroxybutanedioate 1-(((3-(2-(Dimethylamino)ethyl)indol-5-yl)methyl)sulfonyl)pyrrolidine malate
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|
| xref |
KEGG DRUG:D02825 CASRN:181183-52-8 ChEMBL:774472 DrugBank:DB00918 Beilstein:11352387 DrugBank:181183-52-8
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| subClassOf |
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