CAS 102583-47-1 is the registry number for Validamycin B. Offered by: Chemat Brand, TRC, Biosynth. Available pack sizes: on request, 25mg, 1mg, 5mg, 10mg, 50mg.
(2S,3R,4R,5S,6S)-2-(hydroxymethyl)-6-[(1R,2R,3S,4R,5R,6S)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-[[(1R,4S,5R,6R)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxyoxane-3,4,5-triol (CAS 102583-47-1) is a chemical compound with the molecular formula C20H35NO14 and a molecular weight of 513.5 g/mol. IUPAC name: (2S,3R,4R,5S,6S)-2-(hydroxymethyl)-6-[(1R,2R,3S,4R,5R,6S)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-[[(1R,4S,5R,6R)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxyoxane-3,4,5-triol. InChIKey: QYKWCMVFBWGYRE-IVFZNUECSA-N.
| Molecular formula | C20H35NO14 |
|---|---|
| Molecular weight | 513.5 g/mol |
| IUPAC name | (2S,3R,4R,5S,6S)-2-(hydroxymethyl)-6-[(1R,2R,3S,4R,5R,6S)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-[[(1R,4S,5R,6R)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino]cyclohexyl]oxyoxane-3,4,5-triol |
| InChIKey | QYKWCMVFBWGYRE-IVFZNUECSA-N |
| SMILES | C1=C([C@@H]([C@H]([C@@H]([C@@H]1N[C@@H]2[C@@H]([C@@H]([C@H]([C@@H]([C@H]2O)O)O[C@@H]3[C@H]([C@@H]([C@H]([C@@H](O3)CO)O)O)O)CO)O)O)O)O)CO |
Computed by PubChem (NCBI)