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CHEBI:50922 - eletriptan
| Formula | C22H26N2O2S |
| Net Charge | 0 |
| Average Mass | 382.529 |
| Monoisotopic Mass | 382.17150 |
| SMILES | CN1CCC[C@@H]1Cc1cnc2ccc(CCS(=O)(=O)c3ccccc3)cc12 |
| InChI | InChI=1S/C22H26N2O2S/c1-24-12-5-6-19(24)15-18-16-23-22-10-9-17(14-21(18)22)11-13-27(25,26)20-7-3-2-4-8-20/h2-4,7-10,14,16,19,23H,5-6,11-13,15H2,1H3/t19-/m1/s1 |
| InChIKey | PWVXXGRKLHYWKM-LJQANCHMSA-N |
| Wikipedia |
|---|
| Roles Classification |
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| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Role: | serotonergic agonist An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders. |
| Applications: | serotonergic agonist An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders. non-steroidal anti-inflammatory drug An anti-inflammatory drug that is not a steroid. In addition to anti-inflammatory actions, non-steroidal anti-inflammatory drugs have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. vasoconstrictor agent Drug used to cause constriction of the blood vessels. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| eletriptan (CHEBI:50922) has role non-steroidal anti-inflammatory drug (CHEBI:35475) |
| eletriptan (CHEBI:50922) has role serotonergic agonist (CHEBI:35941) |
| eletriptan (CHEBI:50922) has role vasoconstrictor agent (CHEBI:50514) |
| eletriptan (CHEBI:50922) is a N-alkylpyrrolidine (CHEBI:46775) |
| eletriptan (CHEBI:50922) is a indoles (CHEBI:24828) |
| eletriptan (CHEBI:50922) is a sulfone (CHEBI:35850) |
| eletriptan (CHEBI:50922) is conjugate base of eletriptan(1+) (CHEBI:61177) |
| Incoming Relation(s) |
| eletriptan(1+) (CHEBI:61177) is conjugate acid of eletriptan (CHEBI:50922) |
| IUPAC Name |
|---|
| 3-{[(2R)-1-methylpyrrolidin-2-yl]methyl}-5-[2-(phenylsulfonyl)ethyl]-1H-indole |
| INNs | Source |
|---|---|
| eletriptan | ChemIDplus |
| élétriptan | ChEBI |
| eletriptán | ChEBI |
| eletriptanum | ChEBI |
| Registry Numbers | Sources |
|---|---|
| Reaxys:8441596 | Reaxys |
| CAS:143322-58-1 | ChemIDplus |