Nem-S-G
(2R)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[2-(2,5-dioxopyrrol-1-yl)ethylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
Also Known As: Nem-S-G|Ethyl maleimide-S-glutathione|N-Ethylmaleimide-S-glutathione|N-(S-(2-(2,5-Dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl)-N-L-gamma-glutamyl-L-cysteinyl)glycine|(2R)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[2-(2,5-dioxopyrrol-1-yl)ethylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid|d-|A-glutamyl-s-[2-(2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl)ethyl]-l-cysteinylglycine|Glycine, N-(S-(2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethyl)-N-L-gamma-glutamyl-L-cysteinyl)-
| Molecular Formula | C16H22N4O8S |
|---|---|
| Molecular Weight | 430.11584 g/mol |
| LogP | -4.9 |
| Topological Polar Surface Area | 222.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 430.11584 |
| Monoisotopic Mass | 430.11584 |
| Heavy Atoms | 29 |
| Complexity | 693.0 |
Chemical Identifiers
| CAS Number | 5446-05-9 |
|---|---|
| SMILES | C1=CC(=O)N(C1=O)CCSC[C@@H](C(=O)NCC(=O)O)NC(=O)CC[C@H](C(=O)O)N |
| InChIKey | VQDKPBCISILESC-ZJUUUORDSA-N |
Product Overview
Nem-S-G (CAS 5446-05-9), with molecular formula C16H22N4O8S and molecular weight 430.11584 g/mol. IUPAC: (2R)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[2-(2,5-dioxopyrrol-1-yl)ethylsulfanyl]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid.