| SpectraBase Spectrum ID |
ux8iHELNNE |
| Name |
L-Cysteine |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
4371-52-2
52-90-4
7048-04-6 |
| ChEBI ID |
17561 |
| Comments |
100 mM L-Cysteine - vendor: Sigma c7352; Solvent: D2O; Buffers, etc: 50 mM Sodium Phosphate, 500 uM NaAzide; Temperature=298 K, pH=7.4; NMR Reference: 500 uM DSS; Bruker DMX 400MHz
(Data collected by Madison Metabolomics Consortium) |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C3H7NO2S |
| IUPAC Name |
(2R)-2-amino-3-sulfanyl-propanoic acid; (2R)-2-amino-3-mercapto-propanoic acid |
| InChI |
InChI=1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1 |
| InChIKey |
XUJNEKJLAYXESH-REOHCLBHSA-N |
| KEGG Compound ID |
C00097 |
| KEGG Pathways |
PATH: map00260 Glycine, serine and threonine metabolism
PATH: map00271 Methionine metabolism
PATH: map00272 Cysteine metabolism
PATH: map00311 Penicillins and cephalosporins biosynthesis
PATH: map00430 Taurine and hypotaurine metabolism
PATH: map00480 Glutathione metabolism
PATH: map00770 Pantothenate and CoA biosynthesis
PATH: map00920 Sulfur metabolism
PATH: map00970 Aminoacyl-tRNA biosynthesis |
| PubChem Compound ID |
5862 |
| SMILES |
C(C(C(=O)O)N)S |
| Source File Reference |
bmse000034 |
