Apa-SG
(2S)-2-amino-5-[[(2R)-2-amino-3-[2-(4-azidophenyl)-2-oxoethyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid
Also Known As: Apa-SG|Spap-gsh|S-(p-Azidophenacyl)glutathione|S-(4-Azidophenacyl)glutathione|s-[2-(4-azidophenyl)-2-oxoethyl]-l-cysteinyl-n-l-|A-glutamylglycine|(2S)-2-amino-5-[[(2R)-2-amino-3-[2-(4-azidophenyl)-2-oxoethyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid|S-[2-(4-Azidophenyl)-2-oxoethyl]-L-cysteinyl-N-(L-gamma-glutamyl)glycine|Glycine, N-(S-(2-(4-azidophenyl)-2-oxoethyl)-N-L-gamma-glutamyl-L-cysteinyl)-
| Molecular Formula | C18H22N6O7S |
|---|---|
| Molecular Weight | 466.12708 g/mol |
| LogP | -4.4 |
| Topological Polar Surface Area | 221.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 13 |
| Exact Mass | 466.12708 |
| Monoisotopic Mass | 466.12708 |
| Heavy Atoms | 32 |
| Complexity | 765.0 |
Chemical Identifiers
| CAS Number | 763-13-3 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)CSC[C@@H](C(=O)N(CC(=O)O)C(=O)CC[C@@H](C(=O)O)N)N)N=[N+]=[N-] |
| InChIKey | JUILQQZYAXAGPV-STQMWFEESA-N |
Product Overview
Apa-SG (CAS 763-13-3), with molecular formula C18H22N6O7S and molecular weight 466.12708 g/mol. IUPAC: (2S)-2-amino-5-[[(2R)-2-amino-3-[2-(4-azidophenyl)-2-oxoethyl]sulfanylpropanoyl]-(carboxymethyl)amino]-5-oxopentanoic acid.
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