Account ((2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3-((diethoxyphosphoryl)methyl)-4-hydroxytetrahydrofuran-2-yl)methyl benzoate
- Catalog No. :
- ACSCUP792
- CAS No. :
- 90012-84-3
- Molecular Formula :
- C22H28N5O7P
- Molecular Weight :
- 505.47
IUPAC Name:((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3-((diethoxyphosphoryl)methyl)-4-hydroxytetrahydrofuran-2-yl)methyl benzoate
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Product Information
| Product Name | ((2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3-((diethoxyphosphoryl)methyl)-4-hydroxytetrahydrofuran-2-yl)methyl benzoate |
|---|---|
| IUPAC Name | ((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3-((diethoxyphosphoryl)methyl)-4-hydroxytetrahydrofuran-2-yl)methyl benzoate |
| Molecular Formula | C22H28N5O7P |
| Molecular Weight | 505.47 |
| SMILES | O=C(OC[C@H]1O[C@@H](N2C=NC3=C(N)N=CN=C23)[C@H](O)[C@@H]1CP(OCC)(OCC)=O)C4=CC=CC=C4 |
| InChI Key | AQKBRJPDHUBYCZ-BZSOYRFXSA-N |
| Synonym | Adenosine, 3'-deoxy-3'-[(diethoxyphosphinyl)methyl]-, 5'-benzoate (9CI) |
| CAS No. | 90012-84-3 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACSCUP792 Molecular Building Block Synthetic Route
((2S,3S,5R)-5-(6-Amino-9H-purin-9-yl)-3-((diethoxyphosphoryl)methyl)tetrahydrofuran-2-yl)methyl benzoate
(((2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl)methyl)phosphonic acid
(((2S,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl)difluoromethyl)phosphonic acid