Account (2S,3S,4S,5R,6S)-6-(((S)-2-(3-Benzoylphenyl)propanoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
- Catalog No. :
- ACUJMT613
- CAS No. :
- 140148-26-1
- Molecular Formula :
- C22H22O9
- Molecular Weight :
- 430.41
IUPAC Name:(2S,3S,4S,5R,6S)-6-(((S)-2-(3-benzoylphenyl)propanoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
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Product Information
| Product Name | (2S,3S,4S,5R,6S)-6-(((S)-2-(3-Benzoylphenyl)propanoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid |
|---|---|
| IUPAC Name | (2S,3S,4S,5R,6S)-6-(((S)-2-(3-benzoylphenyl)propanoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid |
| Molecular Formula | C22H22O9 |
| Molecular Weight | 430.41 |
| SMILES | O=C([C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](OC([C@H](C2=CC=CC(C(C3=CC=CC=C3)=O)=C2)C)=O)O1)O |
| InChI Key | PBTXSZZKPHBHMA-QVTYPLGRSA-N |
| Synonym | (S)-Ketoprofen Acyl-β-D-glucuronide;1-[(αS)-3-Benzoyl-α-Methylbenzeneacetate];(S)-Ketoprofen b-D-glucuronide;β-D-Glucopyranuronic acid, 1-[(αS)-3-benzoyl-α-methylbenzeneacetate];(S) ketoprofen glucuronide |
| CAS No. | 140148-26-1 |
Synthetic Route by SureRoute
2. ACUJMT613 Molecular Building Block Synthetic Route
(2S,3S,4S,5R,6S)-6-(((R)-2-(3-Benzoylphenyl)propanoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
(2S,3S,4S,5R,6S)-6-((2-(3-Benzoylphenyl)propanoyl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-((2-(3-(hydroxy(phenyl)methyl)phenyl)propanoyl)oxy)tetrahydro-2H-pyran-2-carboxylic acid