Dataset

Levamisole

This MassBank record with Accession MSBNK-Fiocruz-FIO00334 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-FIO00334
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T16:35:43.198347
MetadataModified	2024-01-11T16:35:43.375953
MetadataPublished	2016-01-19

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

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