Dataset

Olanzapine

This MassBank record with Accession MSBNK-Waters-WA002211 contains the MS mass spectrum of Olanzapine with the InChIkey KVWDHTXUZHCGIO-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3
SMILES CN(C4)CCN(C4)C(=N1)c(c3)c(sc(C)3)Nc(c2)c(ccc2)1
InChI Key KVWDHTXUZHCGIO-UHFFFAOYSA-N
Molecular Formula C17H20N4S
Exact Mass 312.141 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002211
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:50:19.112243
MetadataModified 2024-01-11T22:50:19.263025
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
PD000646 ProbesDrugs
N7U69T4SZR FDA SRS
olanzapine Atlas
DB00334 DrugBank
14923451 PubChem: Thomson Pharma
SCHEMBL28763 SureChEMBL
Olanzapine(Zyprexa) Selleck
132539-06-1 ACToR
10021706 NMRShiftDB
J489.991A Nikkaji
LY170053 clinicaltrials
OLANZAPINE clinicaltrials
OLANZAPINE MYLAN clinicaltrials
OLANZAPINE PAMOATE clinicaltrials
LY-170053 clinicaltrials
HY-14541 MedChemExpress
DTXSID9023388 EPA CompTox Dashboard
LSM-5359 LINCS
1982 DrugCentral
UNOGIN CCDC
35254 BindingDB
CB34188691 ChemicalBook
CB64188692 ChemicalBook
CB04188690 ChemicalBook
OLANZAPINE DailyMed
OLANZAPINE rxnorm
OLANZAPINE PAMOATE rxnorm
OLANZAPINE PAMOATE MONOHYDRATE rxnorm
ZYPREXA rxnorm
OLANSEK clinicaltrials
ZYPREXA clinicaltrials
7606 Brenda
135398745 PubChem
ZINC000052957434 ZINC
HMDB0005012 Human Metabolome Database
CB6755515 ChemicalBook
olanzapine DailyMed
CB52743465 ChemicalBook
C07322 KEGG Ligand
12014657 PubChem: Drugs of the Future
CHEMBL715 ChEMBL
7735 ChEBI
SAM001246652 NIH Clinical Collection
902226 eMolecules
The data in this table is sourced from UniChem at EBI.