Account (4AR,6R,7R,7aR)-6-(6-amino-8-bromo-9H-purin-9-yl)-2-mercapto-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl butyrate
- Catalog No. :
- ACYZVQ489
- CAS No. :
- 788807-32-9
- Molecular Formula :
- C14H17BrN5O6PS
- Molecular Weight :
- 494.26
IUPAC Name:(4aR,6R,7R,7aR)-6-(6-amino-8-bromo-9H-purin-9-yl)-2-hydroxy-2-sulfidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl butyrate
![(4AR,6R,7R,7aR)-6-(6-amino-8-bromo-9H-purin-9-yl)-2-mercapto-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl butyrate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (4AR,6R,7R,7aR)-6-(6-amino-8-bromo-9H-purin-9-yl)-2-mercapto-2-oxidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl butyrate |
|---|---|
| IUPAC Name | (4aR,6R,7R,7aR)-6-(6-amino-8-bromo-9H-purin-9-yl)-2-hydroxy-2-sulfidotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl butyrate |
| Molecular Formula | C14H17BrN5O6PS |
| Molecular Weight | 494.26 |
| SMILES | CCCC(O[C@H]1[C@H](N2C(Br)=NC3=C(N)N=CN=C23)O[C@@]4([H])[C@@]1([H])OP(OC4)(S)=O)=O |
| InChI Key | KWTXVSKODFLFLA-FURJIFEMSA-N |
| Synonym | Rp-8-Br-2'-O-MB-cAMPS;Adenosine, 8-bromo-, cyclic 3',5'-[hydrogen (R)-phosphorothioate] 2'-butanoate (9CI) |
| CAS No. | 788807-32-9 |
Synthetic Route by SureRoute
2. ACYZVQ489 Molecular Building Block Synthetic Route
Sp-8-Br-cAMPS sodium
(4aR,6R,7R,7aS)-6-(6-amino-8-bromo-9H-purin-9-yl)-7-hydroxy-2-mercaptotetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinine 2-oxide
Sodium [(2R,4aR,6R,7R,7aS)-6-(6-amino-8-bromo-9H-purin-9-yl)-7-hydroxy-2-oxo-hexahydro-2λ-furo[3,2-d][1,3,2]dioxaphosphinin-2-yl]sulfanide