CAS 114661-01-7 appears in our catalog under these names: 2-Acetamido-6-O-(a-2-N-acetylneuraminyl)-2-deoxy-a-D-galactopyranosyl serine, STn/sialyl-Tn, 97.0%. Offered by: Biosynth, MedChemExpress, Roth. Available pack sizes: 2mg, 1mg, 5mg, 10mg, 25mg, 1 mg.
O-[N-acetyl-alpha-neuraminyl-(2->6)-N-acetyl-alpha-D-galactosaminyl]-L-serine is a non-proteinogenic L-alpha-amino acid that is N-acetyl-alpha-neuraminyl-(26)-N-acetyl-alpha-D-galactosamine linked via an alpha glycosidic bond to the O at position 3 of L-serine. It is an O-[N-acetyl-alpha-neuraminyl-(2->6)-N-acetyl-alpha-D-galactosaminyl]-serine, a non-proteinogenic L-alpha-amino acid and a L-serine derivative.
Source: ChEBI
| Molecular formula | C22H37N3O16 |
|---|---|
| Molecular weight | 599.5 g/mol |
| IUPAC name | (2R,4S,5R,6R)-5-acetamido-2-[[(2R,3R,4R,5R,6S)-5-acetamido-6-[(2S)-2-amino-2-carboxyethoxy]-3,4-dihydroxyoxan-2-yl]methoxy]-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid |
| InChIKey | RMINQIRDFIBNLE-NNRWGFCXSA-N |
| SMILES | CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)OC[C@@H](C(=O)O)N)NC(=O)C)O)O)O |
Computed by PubChem (NCBI)