Account ((2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-9-methoxy-6-oxo-2,3,4,4a,6,10b-hexahydropyrano[3,2-c]isochromen-2-yl)methyl 3,4,5-trihydroxybenzoate
- Catalog No. :
- ACSHWN884
- CAS No. :
- 82958-44-9
- Molecular Formula :
- C21H20O13
- Molecular Weight :
- 480.38
IUPAC Name:((2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-9-methoxy-6-oxo-2,3,4,4a,6,10b-hexahydropyrano[3,2-c]isochromen-2-yl)methyl 3,4,5-trihydroxybenzoate
![((2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-9-methoxy-6-oxo-2,3,4,4a,6,10b-hexahydropyrano[3,2-c]isochromen-2-yl)methyl 3,4,5-trihydroxybenzoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | ((2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-9-methoxy-6-oxo-2,3,4,4a,6,10b-hexahydropyrano[3,2-c]isochromen-2-yl)methyl 3,4,5-trihydroxybenzoate |
|---|---|
| IUPAC Name | ((2R,3S,4S,4aR,10bS)-3,4,8,10-tetrahydroxy-9-methoxy-6-oxo-2,3,4,4a,6,10b-hexahydropyrano[3,2-c]isochromen-2-yl)methyl 3,4,5-trihydroxybenzoate |
| Molecular Formula | C21H20O13 |
| Molecular Weight | 480.38 |
| SMILES | COC1=C(O)C=C2C(=O)O[C@@H]3[C@@H](O)[C@H](O)[C@@H](COC(=O)C4=CC(O)=C(O)C(O)=C4)O[C@H]3C2=C1O |
| InChI Key | CDRRULDABVKKHU-YQBPHPIXSA-N |
| Synonym | 11-O-Galloylbergenin;Benzoic acid, 3,4,5-trihydroxy-, [(2R,3S,4S,4aR,10bS)-2,3,4,4a,6,10b-hexahydro-3,4,8,10-tetrahydroxy-9-methoxy-6-oxopyrano[3,2-c][2]benzopyran-2-yl]methyl ester;11 O Galloylbergenin,11OGalloylbergenin;Pyrano[3,2-c][2]benzopyran,benzoic acid deriv.;11-O-Galloylbergenin, 10 mM in DMSO |
| CAS No. | 82958-44-9 |
Synthetic Route by SureRoute
2. ACSHWN884 Molecular Building Block Synthetic Route
(2R,3S,4S,4aR,10bS)-3,4,8,10-Tetrahydroxy-2-(hydroxymethyl)-9-methoxy-3,4,4a,10b-tetrahydropyrano[3,2-c]isochromen-6(2H)-one
Bergenin monohydrate
3,8,10-trihydroxy-2-(hydroxymethyl)-9-methoxy-6-oxo-2,3,4,4a,6,10b-hexahydropyrano[3,2-c]isochromen-4-yl 3,4,5-trihydroxybenzoate