Dataset

Levamisole

This MassBank record with Accession MSBNK-Fiocruz-FIO00332 contains the MS2 mass spectrum of Levamisole with the InChIkey HLFSDGLLUJUHTE-SNVBAGLBSA-N.

Chemical Info

InChI	InChI=1S/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2/t10-/m1/s1
SMILES	c(c3)ccc(c3)C(C1)N=C(S2)N(CC2)1
InChI Key	HLFSDGLLUJUHTE-SNVBAGLBSA-N
Molecular Formula	C11H12N2S
Exact Mass	204.072 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-Fiocruz-FIO00332
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T16:36:15.250722
MetadataModified	2024-01-11T16:36:15.461054
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
26879	PubChem
14748767	PubChem: Thomson Pharma
PD009109	ProbesDrugs
2880D3468G	FDA SRS
15171780	PubChem: Thomson Pharma
14769-73-4	ACToR
PA450205	PharmGKB
LSM-6655	LINCS
SAWJIJ	CCDC
MCULE-4392506462	Mcule
SCHEMBL19227	SureChEMBL
J8.518I	Nikkaji
7210	Guide to Pharmacology
6432	ChEBI
ZINC000000119839	ZINC
DTXSID4023206	EPA CompTox Dashboard
1561	DrugCentral
R 12,564	clinicaltrials
ERGAMISOL	clinicaltrials
KETRAX	clinicaltrials
50241179	BindingDB
LEVAMISOLE	rxnorm
LEVAMISOLE HYDROCHLORIDE	rxnorm
NSC-177023	clinicaltrials
LEVAMISOLE	clinicaltrials
LEVAMISOLE HYDROCHLORIDE	clinicaltrials
R-12564	clinicaltrials
HMDB0014986	Human Metabolome Database
3477	Brenda
CHEMBL1454	ChEMBL
DB00848	DrugBank
C07070	KEGG Ligand
29542986	eMolecules
The data in this table is sourced from UniChem at EBI.