Account Flovagatran
- Catalog No. :
- ACTJQM336
- CAS No. :
- 871576-03-3
- Molecular Formula :
- C27H36BN3O7
- Molecular Weight :
- 525.41
IUPAC Name:((R)-1-((S)-1-(((benzyloxy)carbonyl)-D-phenylalanyl)pyrrolidine-2-carboxamido)-4-methoxybutyl)boronic acid
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Product Information
| Product Name | Flovagatran |
|---|---|
| IUPAC Name | ((R)-1-((S)-1-(((benzyloxy)carbonyl)-D-phenylalanyl)pyrrolidine-2-carboxamido)-4-methoxybutyl)boronic acid |
| Molecular Formula | C27H36BN3O7 |
| Molecular Weight | 525.41 |
| SMILES | O=C(N[C@H](B(O)O)CCCOC)[C@H]1N(C([C@@H](CC2=CC=CC=C2)NC(OCC3=CC=CC=C3)=O)=O)CCC1 |
| InChI Key | PAOGOXGDGABPSC-SGNDLWITSA-N |
| Synonym | TGN 255;PAOGOXGDGABPSC-SGNDLWITSA-N;Flovagatran;L-Prolinamide, N-[(phenylmethoxy)carbonyl]-D-phenylalanyl-N-[(1R)-1-borono-4-methoxybutyl]- |
| CAS No. | 871576-03-3 |
Synthetic Route by SureRoute
2. ACTJQM336 Molecular Building Block Synthetic Route
sodium hydrogen ((R)-1-((S)-1-(((benzyloxy)carbonyl)-D-phenylalanyl)pyrrolidine-2-carboxamido)-4-methoxybutyl)boronate
((S)-1-((S)-2-((((benzyloxy)carbonyl)-D-phenylalanyl)carbamoyl)pyrrolidin-1-yl)-4-methoxybutyl)boronic acid
Benzyl (1-(2-((4-methoxy-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)butyl)carbamoyl)pyrrolidin-1-yl)-1-oxo-3-phenylpropan-2-yl)carbamate