Account (2S,4S,E)-Methyl 3-ethylidene-4-(2-oxo-2-(4-(2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)ethyl)phenoxy)ethyl)-2-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate
- Catalog No. :
- ACXXHL856
- CAS No. :
- 148245-77-6
- Molecular Formula :
- C31H42O17
- Molecular Weight :
- 686.66
IUPAC Name:methyl (2S,4S,E)-3-ethylidene-4-(2-oxo-2-(4-(2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)ethyl)phenoxy)ethyl)-2-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate
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Product Information
| Product Name | (2S,4S,E)-Methyl 3-ethylidene-4-(2-oxo-2-(4-(2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)ethyl)phenoxy)ethyl)-2-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate |
|---|---|
| IUPAC Name | methyl (2S,4S,E)-3-ethylidene-4-(2-oxo-2-(4-(2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)ethyl)phenoxy)ethyl)-2-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate |
| Molecular Formula | C31H42O17 |
| Molecular Weight | 686.66 |
| SMILES | C/C=C1/[C@H](OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)[C@H]1CC(=O)OC1=CC=C(CCO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1 |
| InChI Key | YZKWKMFJOBZHGV-QVVFYTCBSA-N |
| Synonym | 1''-O-β-D-glucosylformoside;1'''-O-beta-D-Glucopyranosylformoside;1'''-O-β-D-Glucopyranosylformoside;2H-Pyran-4-acetic acid, 3-ethylidene-2-(hexopyranosyloxy)-3,4-dihydro-5-(methoxycarbonyl)-, 4-[2-(β-D-glucopyranosyloxy)ethyl]phenyl ester, (2S,3E,4S)-;1-O-β-D-glucosylformoside;1''-?O-?β-?D-?glucosylformoside;1''-O-beta-D-glucopyranosylformoside |
| CAS No. | 148245-77-6 |
Synthetic Route by SureRoute
2. ACXXHL856 Molecular Building Block Synthetic Route
Methyl (2S,4S,E)-3-ethylidene-4-(2-(4-(2-(((2R,3R,4S,5S,6R)-6-((2-((2S,4S,E)-3-ethylidene-5-(methoxycarbonyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-4-yl)acetoxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)ethyl)phenoxy)-2-oxoethyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate
(2S,4S,E)-Methyl 3-ethylidene-4-(2-oxo-2-(((2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(4-hydroxyphenethoxy)tetrahydro-2H-pyran-2-yl)methoxy)ethyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate
Methyl (2S,4S,Z)-3-ethylidene-4-(2-oxo-2-(((2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(4-hydroxyphenethoxy)tetrahydro-2H-pyran-2-yl)methoxy)ethyl)-2-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-3,4-dihydro-2H-pyran-5-carboxylate