Account (2S,3S,4S,5R,6R)-6-((1-(4-(2-amino-2-oxoethyl)phenoxy)-3-(isopropylamino)propan-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
- Catalog No. :
- ACAFGB356
- CAS No. :
- 889359-84-6
- Molecular Formula :
- C20H30N2O9
- Molecular Weight :
- 442.46
IUPAC Name:(2S,3S,4S,5R,6R)-6-((1-(4-(2-amino-2-oxoethyl)phenoxy)-3-(isopropylamino)propan-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
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Product Information
| Product Name | (2S,3S,4S,5R,6R)-6-((1-(4-(2-amino-2-oxoethyl)phenoxy)-3-(isopropylamino)propan-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid |
|---|---|
| IUPAC Name | (2S,3S,4S,5R,6R)-6-((1-(4-(2-amino-2-oxoethyl)phenoxy)-3-(isopropylamino)propan-2-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid |
| Molecular Formula | C20H30N2O9 |
| Molecular Weight | 442.46 |
| SMILES | O=C([C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](OC(CNC(C)C)COC2=CC=C(CC(N)=O)C=C2)O1)O |
| InChI Key | TUFRIQODZMVHRP-RLYWBOKJSA-N |
| Synonym | Atenolol β-D-Glucuronide;(R,S)-Atenolol O-β-D-glucuronide;β-D-Glucopyranosiduronic acid, 2-[4-(2-amino-2-oxoethyl)phenoxy]-1-[[(1-methylethyl)amino]methyl]ethyl |
| CAS No. | 889359-84-6 |
Synthetic Route by SureRoute
2. ACAFGB356 Molecular Building Block Synthetic Route
Sodium (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(((R)-1-(isopropylamino)-3-(naphthalen-1-yloxy)propan-2-yl)oxy)tetrahydro-2H-pyran-2-carboxylate
4-Acetylphenyl 2,2,7,7-tetramethyltetrahydro-5H-bis([1,3]dioxolo)[4,5-b:4',5'-d]pyran-5-carboxylate
(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(p-tolyloxy)tetrahydro-2H-pyran-2-carboxylic acid