L-Cysteine-S-sulfate

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Systematic / IUPAC Name: 2-Amino-3-sulfosulfanylpropanoic acid

ID: Reference465

Other Names: 3-(Sulfosulfanyl)-L-alanine;
S-Sulfocysteine;
S-Sulfo-L-cysteine;
Cysteine-S-sulfonate;
Cysteinyl-S-sulfonate ; more

Formula: C3H7NO5S2

Class: Endogenous Metabolites

Spectral Data

L-Cysteine-S-sulfate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 2
No. of Spectra 419
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI
Analyzers FT
Last Modification 1/23/2015 12:55:39 PM
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Identificators

InChI InChI=1S/C3H7NO5S2/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m0/s1
InChI Key NOKPBJYHPHHWAN-REOHCLBHSA-N
Canonical SMILES O=S(=O)(O)SCC(C(=O)O)N
CAS 1637714
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Other Names 3-(Sulfosulfanyl)-L-alanine;
S-Sulfocysteine;
S-Sulfo-L-cysteine;
Cysteine-S-sulfonate;
Cysteinyl-S-sulfonate;
Cysteinyl-S-sulfonic acid;
S-Sulpho-L-cysteine;
L-Cysteine-S-sulfonate;
L-Cysteinesulfonic acid;
S-Cysteinesulfonic acid;
Cysteine-S-sulfonic acid

In Other Databases

HMDb HMDB00731
PubChem 115015
ChEBI CHEBI:27891
KEGG C05824
ChEMBL CHEMBL457665
ChemSpider 102939
ChemIDPlus 007381671; 001637714