Account Allyl (6aS,7R,13S,14R,16R)-5-(allyloxy)-14-cyano-8-hydroxy-16-(hydroxymethyl)-9-methoxy-4-methyl-10-(((trifluoromethyl)sulfonyl)oxy)-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate
- Catalog No. :
- ACBAPE287
- CAS No. :
- 182201-66-7
- Molecular Formula :
- C32H32F3N3O11S
- Molecular Weight :
- 723.68
IUPAC Name:allyl (6aS,7R,13S,14R,16R)-5-(allyloxy)-14-cyano-8-hydroxy-16-(hydroxymethyl)-9-methoxy-4-methyl-10-(((trifluoromethyl)sulfonyl)oxy)-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate
![Allyl (6aS,7R,13S,14R,16R)-5-(allyloxy)-14-cyano-8-hydroxy-16-(hydroxymethyl)-9-methoxy-4-methyl-10-(((trifluoromethyl)sulfonyl)oxy)-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | Allyl (6aS,7R,13S,14R,16R)-5-(allyloxy)-14-cyano-8-hydroxy-16-(hydroxymethyl)-9-methoxy-4-methyl-10-(((trifluoromethyl)sulfonyl)oxy)-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate |
|---|---|
| IUPAC Name | allyl (6aS,7R,13S,14R,16R)-5-(allyloxy)-14-cyano-8-hydroxy-16-(hydroxymethyl)-9-methoxy-4-methyl-10-(((trifluoromethyl)sulfonyl)oxy)-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-17-carboxylate |
| Molecular Formula | C32H32F3N3O11S |
| Molecular Weight | 723.68 |
| SMILES | O=C(N1[C@]2([H])C3=C(O)C(OC)=C(OS(=O)(C(F)(F)F)=O)C=C3C[C@@]1([H])[C@H](C#N)N4[C@@H](CO)C5=C(C(OCC=C)=C(C)C6=C5OCO6)C[C@]42[H])OCC=C |
| InChI Key | FCQRICYOIKTALR-SQDATOHTSA-N |
| Synonym | 7,13-Imino-12H-1,3-dioxolo[7,8]isoquino[3,2-b][3]benzazocine-17-carboxylic acid, 14-cyano-6,6a,7,13,14,16-hexahydro-8-hydroxy-16-(hydroxymethyl)-9-methoxy-4-methyl-5-(2-propen-1-yloxy)-10-[[(trifluoromethyl)sulfonyl]oxy]-, 2-propen-1-yl ester, (6aS,7R,13S,14R,16R)- |
| CAS No. | 182201-66-7 |
Synthetic Route by SureRoute
2. ACBAPE287 Molecular Building Block Synthetic Route
(6AS,7R,13S,14R,16R)-16-(((tert-butyldimethylsilyl)oxy)methyl)-14-cyano-5-hydroxy-9-methoxy-8-(methoxymethoxy)-4,17-dimethyl-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinolin-10-yl trifluoromethanesulfonate
(6aS,7R,13S,14R,16R)-16-(((tert-butyldimethylsilyl)oxy)methyl)-5-hydroxy-9-methoxy-8-(methoxymethoxy)-4,10,17-trimethyl-6,6a,7,13,14,16-hexahydro-12H-7,13-epiminobenzo[4,5]azocino[1,2-b][1,3]dioxolo[4,5-h]isoquinoline-14-carbonitrile
(6R,6aR,7R,13S,14R,16R)-5-(Acetyloxy)-6,6a,7,13,14,16-hexahydro-8-hydroxy-9-methoxy-4,10,23-trimethyl-19,20-dioxo-6,16-(epithiopropanoxymethano)-7,13-imino-12H-1,3-dioxolo[7,8]isoquino[3,2-b][3]benzazocine-14-carbonitrile