CAS 111133-91-6 is the registry number for Limocitrin 3,7-diglucoside. Offered by: MedChemExpress. Available pack sizes: 10 mg, 5 mg, 1 mg.
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-methoxy-3,7-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one (CAS 111133-91-6) is a chemical compound with the molecular formula C29H34O18 and a molecular weight of 670.6 g/mol. IUPAC name: 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-methoxy-3,7-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one. InChIKey: ONQXOUJKDHFADF-CUNVQQSLSA-N.
| Molecular formula | C29H34O18 |
|---|---|
| Molecular weight | 670.6 g/mol |
| IUPAC name | 5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-methoxy-3,7-bis[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]chromen-4-one |
| InChIKey | ONQXOUJKDHFADF-CUNVQQSLSA-N |
| SMILES | COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)OC)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O |
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