Account (1-((6-((benzoyloxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-9-yl)methyl benzoate
- Catalog No. :
- ACDKZS307
- CAS No. :
- 184103-78-4
- Molecular Formula :
- C30H32O12
- Molecular Weight :
- 584.57
IUPAC Name:(1-((6-((benzoyloxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-9-yl)methyl benzoate
![(1-((6-((benzoyloxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-9-yl)methyl benzoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (1-((6-((benzoyloxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-9-yl)methyl benzoate |
|---|---|
| IUPAC Name | (1-((6-((benzoyloxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-9-yl)methyl benzoate |
| MDL No. | MFCD34470738 |
| Molecular Formula | C30H32O12 |
| Molecular Weight | 584.57 |
| SMILES | CC12CC(O)C3CC1(OC1OC(COC(=O)C4=CC=CC=C4)C(O)C(O)C1O)C3(COC(=O)C1=CC=CC=C1)C(=O)O2 |
| InChI Key | ZHQGREQIJCCKHT-UHFFFAOYSA-N |
| Synonym | Benzoylalbiflorin;7-Oxatricyclo[4.3.0.03,9]nonan-8-one, 1-[(6-O-benzoyl-β-D-glucopyranosyl)oxy]-9-[(benzoyloxy)methyl]-4-hydroxy-6-methyl-, (1R,3R,4R,6S,9S)-;Paeonivayin;inhibit,Benzoylalbiflorin,Inhibitor;Benzoylalbiflorin, 10 mM in DMSO |
| CAS No. | 184103-78-4 |
| PubChem CID | 154831713 |
Synthetic Route by SureRoute
2. ACDKZS307 Molecular Building Block Synthetic Route
((2R,3S,4S,5R,6S)-6-(((1R,3R,4R,6S,9S)-9-((benzoyloxy)methyl)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-1-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl 3,4,5-trihydroxybenzoate
(3R,4R)-9-((Benzoyloxy)methyl)-6-methyl-8-oxo-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-7-oxatricyclo[4.3.0.03,9]nonan-4-yl 3,4,5-trihydroxybenzoate
((2aR,2a1R,3aR,4aR,5S,6S,7R,8aS,9aR,10aR)-5,6-dihydroxy-7-(hydroxymethyl)-3a-methyl-1-oxooctahydro-3aH,5H-3,4,8,9-tetraoxacyclobuta[6,1]pentaleno[1,2-b]naphthalen-2a1(1H)-yl)methyl benzoate