Account Bisphosphocin Nu-3
- Catalog No. :
- ACNWZP976
- CAS No. :
- 403717-06-6
- Molecular Formula :
- C18H32N2O11P2
- Molecular Weight :
- 514.41
IUPAC Name:((2R,3S,5R)-3-((butoxy(hydroxy)phosphoryl)oxy)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl)methyl butyl hydrogen phosphate
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Product Information
| Product Name | Bisphosphocin Nu-3 |
|---|---|
| IUPAC Name | ((2R,3S,5R)-3-((butoxy(hydroxy)phosphoryl)oxy)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl)methyl butyl hydrogen phosphate |
| Molecular Formula | C18H32N2O11P2 |
| Molecular Weight | 514.41 |
| SMILES | O=P(OCCCC)(OC[C@H]1O[C@@H](N(C(N2)=O)C=C(C)C2=O)C[C@@H]1OP(O)(OCCCC)=O)O |
| InChI Key | ZXQBUNYVGNOEBQ-ARFHVFGLSA-N |
| Synonym | 3'-Thymidylic acid, monobutyl ester, 5'-(butyl hydrogen phosphate);NU-3 |
| CAS No. | 403717-06-6 |
Synthetic Route by SureRoute
2. ACNWZP976 Molecular Building Block Synthetic Route
((2R,3S,5R)-3-Hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-2-yl)methyl ((2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-3-yl) hydrogen phosphate, ammonia salt
sodium (4aR,6R,7aS)-6-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-2-olate 2-oxide
3′-thymidylic acid, 5′-(dihydrogen phosphate)