CHEBI:71015 - perampanel hydrate

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ChEBI Name perampanel hydrate
ChEBI ID CHEBI:71015
Definition A hydrate obtained by combining four molecules of perampanel with three molecules of water. Used as an adjunctive therapy for the treatment of partial-onset seizures in patients with epilepsy.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C92H66N12O7
Net Charge 0
Average Mass 1451.58460
Monoisotopic Mass 1450.51774
InChI InChI=1S/4C23H15N3O.3H2O/c4*24-15-17-8-4-5-11-20(17)21-14-18(22-12-6-7-13-25-22)16-26(23(21)27)19-9-2-1-3-10-19;;;/h4*1-14,16H;3*1H2
InChIKey PDWMJDKMSASBNE-UHFFFAOYSA-N
SMILES O.O.O.O=c1c(cc(cn1-c1ccccc1)-c1ccccn1)-c1ccccc1C#N.O=c1c(cc(cn1-c1ccccc1)-c1ccccn1)-c1ccccc1C#N.O=c1c(cc(cn1-c1ccccc1)-c1ccccn1)-c1ccccc1C#N.O=c1c(cc(cn1-c1ccccc1)-c1ccccn1)-c1ccccc1C#N
Roles Classification
Biological Role(s): AMPA receptor antagonist
An antagonist at the AMPA receptor.
Application(s): anticonvulsant
A drug used to prevent seizures or reduce their severity.
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ChEBI Ontology
Outgoing perampanel hydrate (CHEBI:71015) has part perampanel (CHEBI:71013)
perampanel hydrate (CHEBI:71015) has role AMPA receptor antagonist (CHEBI:71014)
perampanel hydrate (CHEBI:71015) has role anticonvulsant (CHEBI:35623)
perampanel hydrate (CHEBI:71015) is a hydrate (CHEBI:35505)
IUPAC Name
2-(6'-oxo-1'-phenyl-1',6'-dihydro-2,3'-bipyridin-5'-yl)benzonitrile—water(4/3)
Brand Name Source
Fycompa ChEBI
Last Modified
13 November 2012