Account Trilobatin 2''-acetate
- Catalog No. :
- ACHGUD355
- CAS No. :
- 647853-82-5
- Molecular Formula :
- C23H26O11
- Molecular Weight :
- 478.45
IUPAC Name:(2S,3R,4S,5S,6R)-2-(3,5-dihydroxy-4-(3-(4-hydroxyphenyl)propanoyl)phenoxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl acetate
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Product Information
| Product Name | Trilobatin 2''-acetate |
|---|---|
| IUPAC Name | (2S,3R,4S,5S,6R)-2-(3,5-dihydroxy-4-(3-(4-hydroxyphenyl)propanoyl)phenoxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl acetate |
| Molecular Formula | C23H26O11 |
| Molecular Weight | 478.45 |
| SMILES | O=C(C1=C(O)C=C(O[C@H]2[C@@H]([C@H]([C@@H]([C@@H](CO)O2)O)O)OC(C)=O)C=C1O)CCC3=CC=C(O)C=C3 |
| InChI Key | QIEAJYJXGQAYRU-DODNOZFWSA-N |
| Synonym | Trilobatin 2''-acetate;1-Propanone, 1-[4-[(2-O-acetyl-β-D-glucopyranosyl)oxy]-2,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)- |
| CAS No. | 647853-82-5 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P305+P351+P338
Synthetic Route by SureRoute
2. ACHGUD355 Molecular Building Block Synthetic Route
1-(4-(((2S,3R,4S,5S,6R)-4,5-Dihydroxy-6-(hydroxymethyl)-3-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-2,6-dihydroxyphenyl)-3-(4-hydroxyphenyl)propan-1-one
1-(2,6-Dihydroxy-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-3-(4-hydroxyphenyl)propan-1-one
1-(2,6-dihydroxy-4-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-3-phenylpropan-1-one