Dataset

Lansoprazole

This MassBank record with Accession MSBNK-UoB-XB000400 contains the MS2 mass spectrum of Lansoprazole with the InChIkey MJIHNNLFOKEZEW-UHFFFAOYSA-N.

InChI	InChI=1S/C16H14F3N3O2S/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15/h2-7H,8-9H2,1H3,(H,21,22)
SMILES	CC1=C(C=CN=C1CS(=O)C2=NC3=CC=CC=C3N2)OCC(F)(F)F
InChI Key	MJIHNNLFOKEZEW-UHFFFAOYSA-N
Molecular Formula	C16H14F3N3O2S
Exact Mass	369.076 g/mol

Data and Resources

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UoB-XB000400
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:09:39.044062
MetadataModified	2025-02-09T19:56:05.510966
MetadataPublished	2022-11-08

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
0K5C5T2QPG	FDA SRS
1547	DrugCentral
J126.212B	Nikkaji
7208	Guide to Pharmacology
HY-13662	MedChemExpress
ZOTON	clinicaltrials
OGAST	clinicaltrials
AG-1749	clinicaltrials
TAKEPRON	clinicaltrials
PREVACID	clinicaltrials
AGOPTON	clinicaltrials
LANZOR	clinicaltrials
LANSOX	clinicaltrials
LANSOPRAZOLE	clinicaltrials
PREVACID	rxnorm
LANSOPRAZOLE	rxnorm
LANSOPRAZOLE	DailyMed
47032	BindingDB
DTXSID4023200	EPA CompTox Dashboard
SAM001246544	NIH Clinical Collection
DB00448	DrugBank
CHEMBL480	ChEMBL
6375	ChEBI
12013895	PubChem: Drugs of the Future
lansoprazole	DailyMed
4413	Brenda
HMDB0005008	Human Metabolome Database
CB6396972	ChemicalBook
MCULE-8446262134	Mcule
103577-45-3	ACToR
60061656	NMRShiftDB
SCHEMBL22365	SureChEMBL
PA450180	PharmGKB
3883	PubChem
Lansoprazole	Selleck
PD000804	ProbesDrugs
14852955	PubChem: Thomson Pharma
LSM-5064	LINCS
902018	eMolecules
The data in this table is sourced from UniChem at EBI.