CHEBI:188278 - Norquetiapine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Norquetiapine
ChEBI ID CHEBI:188278
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H17N3S
Net Charge 0
Average Mass 295.400
Monoisotopic Mass 295.11432
InChI InChI=1S/C17H17N3S/c1-3-7-15-13(5-1)17(20-11-9-18-10-12-20)19-14-6-2-4-8-16(14)21-15/h1-8,18H,9-12H2
InChIKey JLOAJISUHPIQOX-UHFFFAOYSA-N
SMILES S1C=2C(C(N3CCNCC3)=NC=4C1=CC=CC4)=CC=CC2
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing Norquetiapine (CHEBI:188278) is a dibenzothiazepine (CHEBI:39268)
IUPAC Name
6-piperazin-1-ylbenzo[b][1,4]benzothiazepine
Manual Xref Database
9544835 ChemSpider
View more database links
Registry Number Type Source
5747-48-8 CAS Registry Number ChemIDplus