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Substance
ID:1826461
Structure
Similarity
Functional Group
Text
ID:1094
quetiapine
Chemical Entities of Biological Interest
ID: CHEBI:8707
Names and Identifiers
Synonyms
quetiapine
2-[2-(4-Dibenzo[b,f][1,4]thiazepin-11-yl-1-piperazinyl)ethoxy]ethanol
Quetiapine
International Nonproprietary Name (INN)
quetiapina
quetiapine
quetiapinum
IUPAC name
2-[2-(4-{2-thia-9-azatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,9,12,14-heptaen-10-yl}piperazin-1-yl)ethoxy]ethan-1-ol
IUPAC Traditional name
2-[2-(4-{2-thia-9-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,9,12,14-heptaen-10-yl}piperazin-1-yl)ethoxy]ethanol
Registration numbers
CAS Number
111974-69-7
PubChem CID
5002
KEGG ID
C07397
LINCS Database
LSM-3543
ACToR Database
111974-69-7
BKMS React Database
34576
BRENDA Database
1.2.3.1
3.1.1.1
2.4.1.17
BRENDA Ligand Database
34576
CHEMBL
CHEMBL716
CompTox Database
DTXSID9023546
MetaboLights Database
MTBLS2291
MTBLS407
SureChEMBL Database
SCHEMBL7932
Wikipedia Title
Quetiapine
NMRShiftDB Database
20218786
Patent number
EP1547650
EP1602650
EP1621198
EP1627639
EP1690858
EP1712225
EP1726952
EP1795199
EP1815854
EP1844769
EP1879027
EP1884243
EP1958617
EP1970055
EP1990639
US2005020571
US2005070552
US2006135511
US2006148790
US2006166974
US2006199798
US2006276641
US2007185084
US2007190043
US2007191350
US2007196491
US2007207222
US2007225379
US2007232691
US2007244093
US2007249582
US2007258894
US2007259952
US2007270403
US2008214559
US2008221162
US2008255073
WO2005000807
WO2005012274
WO2005013894
WO2005018635
WO2005063254
WO2005092392
WO2006031610
WO2006031676
WO2006056771
WO2006056772
WO2006077602
WO2006081347
WO2006084833
WO2006117700
WO2007103687
WO2007110878
WO2007124757
WO2007125545
WO2007126898
WO2007128349
WO2007128442
WO2007133802
WO2007137224
WO2008116308
WO2008121415
WO2008127381
WO2008128166
WO2008152434
GeneOntology Database
GO:0097335
DrugBank ID
DB01224
Drug Central Database
2,337
BindingDB Database
50095890
KEGG DRUG Database
D08456
Reactom Database
R-HSA-9654054
R-HSA-9692539
R-HSA-9693478
CHEBI ID
CHEBI:8707
PubChem SID
56394834
Properties
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Molecule Details
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Molecular Spectra
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References
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