Account (2S,3S,4S,5R,6S)-6-((5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid hydrate
- Catalog No. :
- ACZLQC235
- CAS No. :
- 206752-33-2
- Molecular Formula :
- C21H20O12
- Molecular Weight :
- 464.38
IUPAC Name:(2S,3S,4S,5R,6S)-6-((5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid hydrate
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Product Information
| Product Name | (2S,3S,4S,5R,6S)-6-((5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid hydrate |
|---|---|
| IUPAC Name | (2S,3S,4S,5R,6S)-6-((5,6-dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid hydrate |
| MDL No. | MFCD00149302 |
| Molecular Formula | C21H20O12 |
| Molecular Weight | 464.38 |
| SMILES | O.O=C(O)[C@H]1O[C@@H](OC2=C(O)C(O)=C3C(=O)C=C(C4=CC=CC=C4)OC3=C2)[C@H](O)[C@@H](O)[C@@H]1O |
| InChI Key | WLEKZZMZTPAGDD-ZSESPEEFSA-N |
| Synonym | Baicalein 7-O--D-glucuronide | AS-80668 | Baicalin hydrate | (2S,3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid;hydrate |
| CAS No. | 206752-33-2 |
| PubChem CID | 71311447 |
Synthetic Route by SureRoute
2. ACZLQC235 Molecular Building Block Synthetic Route
5,6-Dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-7-yl β-D-Glucopyranosiduronic Acid
(2S,3S,4S,5R,6S)-6-((5,6-Dihydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid hydrate
(2S,3S,4S,5R,6S)-6-((5,6-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid