CHEBI:8707 - quetiapine

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ChEBI Name quetiapine
ChEBI ID CHEBI:8707
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C21H25N3O2S
Net Charge 0
Average Mass 383.50700
Monoisotopic Mass 383.167
InChI InChI=1S/C21H25N3O2S/c25-14-16-26-15-13-23-9-11-24(12-10-23)21-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)22-21/h1-8,25H,9-16H2
InChIKey URKOMYMAXPYINW-UHFFFAOYSA-N
SMILES OCCOCCN1CCN(CC1)C1=Nc2ccccc2Sc2ccccc12
Roles Classification
Biological Role(s): serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
dopaminergic antagonist
A drug that binds to but does not activate dopamine receptors, thereby blocking the actions of dopamine or exogenous agonists.
histamine antagonist
Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
adrenergic antagonist
An agent that binds to but does not activate adrenergic receptors thereby blocking the actions of endogenous or exogenous adrenergic agonists.
Application(s): serotonergic antagonist
Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
dopaminergic antagonist
A drug that binds to but does not activate dopamine receptors, thereby blocking the actions of dopamine or exogenous agonists.
histamine antagonist
Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.
adrenergic antagonist
An agent that binds to but does not activate adrenergic receptors thereby blocking the actions of endogenous or exogenous adrenergic agonists.
second generation antipsychotic
Antipsychotic drugs which can have different modes of action but which tend to be less likely than first generation antipsychotics to cause extrapyramidal motor control disabilities such as body rigidity or Parkinson's disease-type movements.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing quetiapine (CHEBI:8707) has role adrenergic antagonist (CHEBI:37887)
quetiapine (CHEBI:8707) has role dopaminergic antagonist (CHEBI:48561)
quetiapine (CHEBI:8707) has role histamine antagonist (CHEBI:37956)
quetiapine (CHEBI:8707) has role second generation antipsychotic (CHEBI:65191)
quetiapine (CHEBI:8707) has role serotonergic antagonist (CHEBI:48279)
quetiapine (CHEBI:8707) is a N-alkylpiperazine (CHEBI:46845)
quetiapine (CHEBI:8707) is a N-arylpiperazine (CHEBI:46848)
quetiapine (CHEBI:8707) is a dibenzothiazepine (CHEBI:39268)
Incoming quetiapine fumarate (CHEBI:8708) has part quetiapine (CHEBI:8707)
IUPAC Name
2-[2-(4-dibenzo[b,f][1,4]thiazepin-11-ylpiperazin-1-yl)ethoxy]ethanol
INNs Sources
quetiapina ChEBI
quétiapine ChEBI
quetiapine ChEBI
quetiapinum ChEBI
Synonyms Sources
2-[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethanol KEGG COMPOUND
Quetiapine KEGG COMPOUND
Database Links Databases
2337 DrugCentral
C07397 KEGG COMPOUND
D08456 KEGG DRUG
DB01224 DrugBank
EP240228 Patent
LSM-3543 LINCS
Quetiapine Wikipedia
US4879288 Patent
View more database links
Registry Number Type Source
111974-69-7 CAS Registry Number ChemIDplus
Last Modified
22 February 2017