N-Acetyl-L-cysteine

Systematic / IUPAC Name: N-Acetylcysteine

ID: Reference511

Other Names: Acetadote;
Fluimucil;
Mercapturic acid;
Parvolex;
Fluprowit ; more

Formula: C5H9NO3S

Class: Endogenous Metabolites

Spectral Data

N-Acetyl-L-cysteine mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Elite; Q Exactive HF Orbitrap; Q Exactive Orbitrap
No. of Spectral Trees 4
No. of Spectra 491
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI
Analyzers FT
Last Modification 3/25/2015 12:07:22 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C5H9NO3S/c1-3(7)6-4(2-10)5(8)9/h4,10H,2H2,1H3,(H,6,7)(H,8,9)/t4-/m0/s1
InChI Key PWKSKIMOESPYIA-BYPYZUCNSA-N
Canonical SMILES CC(=O)NC(CS)C(=O)O
CAS 616911
Splash
Other Names Acetadote;
Fluimucil;
Mercapturic acid;
Parvolex;
Fluprowit;
Acetein;
Airbron;
Fabrol;
Mucosil;
L-Acetylcysteine;
N-Acetyl cysteine;
Acetylcysteinum;
Fluimucetin;
Flumucetin;
Mucosolvin;
Brunac;
Exomuc;
N-Acetyl-3-mercaptoalanine;
Lysox;
Broncholysin;
Mucolyticum;
Lysomucil;
Mucofilin;
Inspir;
Acetyl-L-cysteine;
Cysteine, N-acetyl, L-;
Respaire;
L-α-Acetamido-β-mercaptopropionic acid;
Fluatox;
Mucolator;
Mucret;
Tixair;
N-Acetyl cystein;
Sodium 2-acetamido-3-mercaptopropionate;
NAC

In Other Databases

ChEMBL CHEMBL600
PubChem 12035
ChemSpider 11540
DrugBank DB06151
KEGG D00221; C06809
ChEBI CHEBI:28939
ChemIDPlus 000616911; 063664540; 084252039; 091918353; 019542746; 066887567
Wikipedia Acetylcysteine
HMDb HMDB01890