Dataset

Fenbendazole

This MassBank record with Accession MSBNK-Athens_Univ-AU106204 contains the MS2 mass spectrum of Fenbendazole with the InChIkey HDDSHPAODJUKPD-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)
SMILES	CO/C(=N/c1[nH]c2cc(ccc2n1)Sc3ccccc3)/O
InChI Key	HDDSHPAODJUKPD-UHFFFAOYSA-N
Molecular Formula	C15H13N3O2S
Exact Mass	299.073 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by-sa/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Athens_Univ-AU106204
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T10:08:02.223200
MetadataModified	2025-02-08T18:57:02.647851
MetadataPublished	2015-09-22
Related Molecule

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
FENBENDAZOLE	rxnorm
PANACUR	rxnorm
PANACUR	clinicaltrials
FENBENDAZOLE	clinicaltrials
HY-B0413	MedChemExpress
DTXSID0040672	EPA CompTox Dashboard
4536	DrugCentral
ZINC000000402911	ZINC
J15.833J	Nikkaji
31047	BindingDB
217129	Brenda
DB11410	DrugBank
LSM-3134	LINCS
CHEMBL37161	ChEMBL
14825202	PubChem: Thomson Pharma
14751684	PubChem: Thomson Pharma
Fenbendazole(Panacur)	Selleck
621BVT9M36	FDA SRS
3334	PubChem
PD001910	ProbesDrugs
43210-67-9	ACToR
SCHEMBL166352	SureChEMBL
31588328	eMolecules
500399	eMolecules
CB9154575	ChemicalBook
77092	Rhea
77382	Brenda
HMDB0029745	Human Metabolome Database
MCULE-9731772039	Mcule
77092	ChEBI
The data in this table is sourced from UniChem at EBI.