Account (5S,E)-3-(hydroxy((2R,4aS,8aR)-2-((E)-prop-1-en-1-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methylene)-5-(hydroxymethyl)-1-methylpyrrolidine-2,4-dione
- Catalog No. :
- ACKGQI199
- CAS No. :
- 57749-43-6
- Molecular Formula :
- C20H27NO4
- Molecular Weight :
- 345.44
IUPAC Name:(5S,E)-3-(hydroxy((2R,4aS,8aR)-2-((E)-prop-1-en-1-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methylene)-5-(hydroxymethyl)-1-methylpyrrolidine-2,4-dione
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Product Information
| Product Name | (5S,E)-3-(hydroxy((2R,4aS,8aR)-2-((E)-prop-1-en-1-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methylene)-5-(hydroxymethyl)-1-methylpyrrolidine-2,4-dione |
|---|---|
| IUPAC Name | (5S,E)-3-(hydroxy((2R,4aS,8aR)-2-((E)-prop-1-en-1-yl)-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)methylene)-5-(hydroxymethyl)-1-methylpyrrolidine-2,4-dione |
| Molecular Formula | C20H27NO4 |
| Molecular Weight | 345.44 |
| SMILES | C/C=C/[C@@H]1C=C[C@@H]2CCCC[C@H]2C1/C(O)=C1/C(=O)[C@H](CO)N(C)C1=O |
| InChI Key | MYCJUSSEOCDPCR-RJGXUQMOSA-N |
| Synonym | EQUISETIN;LS-64262;2,4-Pyrrolidinedione, 5-(hydroxymethyl)-3-[hydroxy[(1S,2R,4aS,6R,8aR)-1,2,4a,5,6,7,8,8a-octahydro-1,6-dimethyl-2-(1E)-1-propen-1-yl-1-naphthalenyl]methylene]-1-methyl-, (3E,5S)-;(3E,5S)-3-[[(1S,2R,4aS,6R,8aR)-1,6-dimethyl-2-[(E)-prop-1-enyl]-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]-hydroxymethylidene]-5-(hydroxymethyl)-1-methylpyrrolidine-2,4-dione;Citalopram Impurity 39;(3E,5S)-3-{[(1S,2R,4aS,6R,8aR)-1,6-dimethyl-2-[(1E)-prop-1-en-1-yl]-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl](hydroxy)methylidene}-5-(hydroxymethyl)-1-methylpyrrolidine-2,4-dione |
| CAS No. | 57749-43-6 |
Synthetic Route by SureRoute
2. ACKGQI199 Molecular Building Block Synthetic Route
JBIR-22
(5S,Z)-3-(((1S,4aR,6S,8R,8aR)-2-((2S,3S)-2,3-dimethyloxiran-2-yl)-6,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)(hydroxy)methylene)-5-isopropyl-1-methylpyrrolidine-2,4-dione
5-(sec-Butyl)-3-((2-(2,3-dimethyloxiran-2-yl)-6,8-dimethyl-1,2,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)(hydroxy)methylene)-1-methylpyrrolidine-2,4-dione