Dataset

Fluphenazine (oxide)

This MassBank record with Accession MSBNK-Waters-WA002240 contains the MS mass spectrum of Fluphenazine (oxide) with the InChIkey PLDUPXSUYLZYBN-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C22H26F3N3OS/c23-22(24,25)17-6-7-21-19(16-17)28(18-4-1-2-5-20(18)30-21)9-3-8-26-10-12-27(13-11-26)14-15-29/h1-2,4-7,16,29H,3,8-15H2
SMILES	OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(C(F)(F)F)3)Sc(cccc2)1
InChI Key	PLDUPXSUYLZYBN-UHFFFAOYSA-N
Molecular Formula	C22H26F3N3OS
Exact Mass	437.175 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-nc/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002240
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T22:49:13.320269
MetadataModified	2024-01-11T22:49:13.487793
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
3372	PubChem
PD009883	ProbesDrugs
fluphenazine	Atlas
S79426A41Z	FDA SRS
LSM-3226	LINCS
14832617	PubChem: Thomson Pharma
69-23-8	ACToR
SCHEMBL19221	SureChEMBL
PA449676	PharmGKB
47646-09-3	ACToR
HMDB0014761	Human Metabolome Database
fluphenazine	DailyMed
97943	Brenda
MolPort-001-727-938	MolPort
CHEMBL726	ChEMBL
5123	ChEBI
204	Guide to Pharmacology
C07010	KEGG Ligand
DB00623	DrugBank
732810	eMolecules
J4.863A	Nikkaji
MCULE-7579992672	Mcule
78433	BindingDB
ZINC000019203912	ZINC
FLUPHENAZINE	DailyMed
FLUPHENAZINE	rxnorm
FLUPHENAZINE HYDROCHLORIDE	rxnorm
CB7107784	ChemicalBook
FLUPHENAZINE HYDROCHLORIDE	clinicaltrials
1212	DrugCentral
PERMITIL	clinicaltrials
FLUPHENAZINE	clinicaltrials
DTXSID2023068	EPA CompTox Dashboard
PROLIXIN	clinicaltrials
The data in this table is sourced from UniChem at EBI.