Dataset

D-(+)-Glucosamine hydrochloride

This MassBank record with Accession MSBNK-Antwerp_Univ-METOX_P100233_9EE2 contains the MS2 mass spectrum of D-(+)-Glucosamine hydrochloride with the InChIkey MSWZFWKMSRAUBD-IVMDWMLBSA-N.

Chemical Info

InChI	InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6?/m1/s1
SMILES	C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)N)O)O)O
InChI Key	MSWZFWKMSRAUBD-IVMDWMLBSA-N
Molecular Formula	C6H13NO5
Exact Mass	179.079 g/mol

Data and Resources

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Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-METOX_P100233_9EE2
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Maintainer
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MetadataCreated	2024-01-11T09:37:43.263690
MetadataModified	2025-02-08T18:52:02.466066
MetadataPublished	2021-12-09
Related Molecule

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
4775230	eMolecules
439213	PubChem
60019474	NMRShiftDB
PD009919	ProbesDrugs
MEDIFLEX	clinicaltrials
SCHEMBL167831	SureChEMBL
15147292	PubChem: Thomson Pharma
14748321	PubChem: Thomson Pharma
47977	ChEBI
PA164747613	PharmGKB
MTBLC47977	Metabolights
93007	Brenda
153843	Brenda
2656	Brenda
HMDB0001514	Human Metabolome Database
96343	Brenda
211430	Brenda
glucosamine	DailyMed
C00329	KEGG Ligand
DB01296	DrugBank
CHEMBL493287	ChEMBL
6101	Brenda
21576	Brenda
699	Brenda
1307	DrugCentral
J412.978D	Nikkaji
233873	Brenda
GLUCOSAMINE	clinicaltrials
GLUCOSAMINE HYDROCHLORIDE	clinicaltrials
GLUCOSAMINE SULFATE	clinicaltrials
GLUCOSAMINE	DailyMed
GLUCOSAMINE HYDROCHLORIDE	rxnorm
GLUCOSAMINE SULFATE	rxnorm
GLUCOSAMINE SULFATE POTASSIUM CHLORIDE	rxnorm
GLUCOSAMINE SULFATE POTASSIUM CHLORIDE	clinicaltrials
COSAMIN	clinicaltrials
GLUCOSAMINE	rxnorm
The data in this table is sourced from UniChem at EBI.