RefMet Compound Details

RefMet ID, RefMet name, exact mass and formula
RefMet ID	RM0040294
RefMet name	Cysteamine
Systematic name	2-aminoethane-1-thiol
Synonyms	PubChem Synonyms
Exact mass	77.029921 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C2H7NS	View other entries in RefMet with this formula
Molecular descriptors
Molfile	38231 (Download molfile/View MW Metabolite Database details)
InChI	InChI=1S/C2H7NS/c3-1-2-4/h4H,1-3H2
InChIKey	UFULAYFCSOUIOV-UHFFFAOYSA-N	View other enantiomers/diastereomers of this metabolite in RefMet
SMILES	C(CS)N Run Tanimoto similarity search (with similarity coefficient >=0.6)
Chemical/Biochemical Classification
Super Class	Organosulfur compounds
Main Class	Organosulfur compounds
Sub Class	Alkylthiols
Distribution of Cysteamine in NMDR studies
Species	Plot Species distribution
Sample source	Plot Sample source(tissue) distribution
Platform	Platform (MS/NMR) used for detection
Chromatography	Chromatography methods used for detection
Studies	NMDR Studies reporting Cysteamine
External Links
Pubchem CID	6058
ChEBI ID	17141
KEGG ID	C01678
HMDB ID	HMDB0002991
Chemspider ID	5834
MetaCyc ID	CPD-239
EPA CompTox	DTXCID902875
Spectral data for Cysteamine standards
BMRB ID(NMR)	View NMR spectra
NP-MRD ID(NMR)	View NMR spectra
MassBank(EU)	View MS spectra
Structural annotation level
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Cysteamine

Rxn ID	KEGG Reaction	Enzyme
R02467	Cysteamine + Oxygen <=> Hypotaurine	Cysteamine:oxygen oxidoreductase

Table of KEGG human pathways containing Cysteamine

Pathway ID	Human Pathway	# of reactions
hsa00430	Taurine and hypotaurine metabolism	1