Dataset

L-Carnitine hydrochloride

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P100201_FB57 contains the MS2 mass spectrum of L-Carnitine hydrochloride with the InChIkey PHIQHXFUZVPYII-ZCFIWIBFSA-N.

Chemical Info

InChI	InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3/t6-/m1/s1
SMILES	C[N+](C)(C)C[C@@H](CC(=O)[O-])O
InChI Key	PHIQHXFUZVPYII-ZCFIWIBFSA-N
Molecular Formula	C7H15NO3
Exact Mass	161.105 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P100201_FB57
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T09:31:25.810425
MetadataModified	2024-01-11T09:31:26.004289
MetadataPublished	2021-12-23

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
DTXSID4023208	EPA CompTox Dashboard
513	DrugCentral
50037268	BindingDB
LEVOCARNITINE	DailyMed
CARNITOR	rxnorm
LEVOCARNITINE	rxnorm
CARNITINE	clinicaltrials
CARNITOR	clinicaltrials
LEVOCARNITINE	clinicaltrials
HY-B0399	MedChemExpress
PA450154	PharmGKB
MTBLC16347	Metabolights
HMDB0000062	Human Metabolome Database
16347	Rhea
levocarnitine	DailyMed
CB4464378	ChemicalBook
60020414	NMRShiftDB
PD000410	ProbesDrugs
0G389FZZ9M	FDA SRS
crn	Recon
15120307	PubChem: Thomson Pharma
44985-71-9	ACToR
L-carnitine(Levocarnitine)	Selleck
15171033	PubChem: Thomson Pharma
541-15-1	ACToR
SCHEMBL21970	SureChEMBL
4780	Guide to Pharmacology
10917	PubChem
DITLAT	CCDC
CHEMBL1149	ChEMBL
16347	ChEBI
C00318	KEGG Ligand
DB00583	DrugBank
489360	eMolecules
The data in this table is sourced from UniChem at EBI.