CAS 81425-28-7 is the registry number for Zizyvoside I. Offered by: MedChemExpress. Available pack sizes: Get quote.
(4S)-4-[(E,3R)-3-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxybut-1-enyl]-4-hydroxy-3,5,5-trimethylcyclohex-2-en-1-one (CAS 81425-28-7) is a chemical compound with the molecular formula C25H40O12 and a molecular weight of 532.6 g/mol. IUPAC name: (4S)-4-[(E,3R)-3-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxybut-1-enyl]-4-hydroxy-3,5,5-trimethylcyclohex-2-en-1-one. InChIKey: SWOFNYOUVWQWHE-WLRUMOBRSA-N.
| Molecular formula | C25H40O12 |
|---|---|
| Molecular weight | 532.6 g/mol |
| IUPAC name | (4S)-4-[(E,3R)-3-[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxybut-1-enyl]-4-hydroxy-3,5,5-trimethylcyclohex-2-en-1-one |
| InChIKey | SWOFNYOUVWQWHE-WLRUMOBRSA-N |
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2O[C@H](C)/C=C/[C@]3(C(=CC(=O)CC3(C)C)C)O)CO)O)O)O)O)O |
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