Account (2S,3R,4S,5R,6R)-6-(((2R,3R,4S,5R,6S)-6-((2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-4,5-dihydroxy-2-methyltetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate
- Catalog No. :
- ACAMMI258
- CAS No. :
- 957110-26-8
- Molecular Formula :
- C36H36O19
- Molecular Weight :
- 772.66
IUPAC Name:(2S,3R,4S,5R,6R)-6-(((2R,3R,4S,5R,6S)-6-((2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-4,5-dihydroxy-2-methyltetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate
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Product Information
| Product Name | (2S,3R,4S,5R,6R)-6-(((2R,3R,4S,5R,6S)-6-((2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-4,5-dihydroxy-2-methyltetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate |
|---|---|
| IUPAC Name | (2S,3R,4S,5R,6R)-6-(((2R,3R,4S,5R,6S)-6-((2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methoxy)-4,5-dihydroxy-2-methyltetrahydro-2H-pyran-3-yl (E)-3-(3,4-dihydroxyphenyl)acrylate |
| Molecular Formula | C36H36O19 |
| Molecular Weight | 772.66 |
| SMILES | C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=C(C4=CC(O)=C(O)C=C4)OC4=CC(O)=CC(O)=C4C3=O)[C@H](O)[C@@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1OC(=O)/C=C/C1=CC(O)=C(O)C=C1 |
| InChI Key | DLYWVZSZZMLYSR-QYJZUGQHSA-N |
| Synonym | Quercetin 3-Caffeylrobinobioside;4H-1-Benzopyran-4-one, 3-[[6-O-[6-deoxy-4-O-[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]-α-L-mannopyranosyl]-β-D-galactopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy- |
| CAS No. | 957110-26-8 |
Synthetic Route by SureRoute
2. ACAMMI258 Molecular Building Block Synthetic Route
Quercetin-3-O-(6''-O-Ecaffeoyl)-β-D-galactopyranoside
((2R,3S,4S,5R,6S)-6-(((2S,3R,4R,5R,6S)-2-((2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-4,5-dihydroxy-6-methyltetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl (E)-3-(3,4-dihydroxyphenyl)acrylate
(2S,3S,4S,5R,6R)-6-(((2R,3R,4S,5R,6S)-6-((2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl)oxy)-3,4-dihydroxy-5-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)methoxy)-5-hydroxy-2-methyl-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-3-yl (E)-3-(4-hydroxyphenyl)acrylate