Account (6aS,8R,9aR,11R,12aS,12bR,13S)-11-(furan-3-yl)-13-methyl-7,8,11,12-tetrahydro-6H,9aH-8,12a-methanofuro[3',2':6,7]oxepino[4,5-d]isobenzofuran-4(12bH)-one
- Catalog No. :
- ACEXEO583
- CAS No. :
- 87321-87-7
- Molecular Formula :
- C20H20O5
- Molecular Weight :
- 340.38
IUPAC Name:(6aS,8R,9aR,11R,12aS,12bR,13S)-11-(furan-3-yl)-13-methyl-7,8,11,12-tetrahydro-6H,9aH-8,12a-methanofuro[3',2':6,7]oxepino[4,5-d]isobenzofuran-4(12bH)-one
![(6aS,8R,9aR,11R,12aS,12bR,13S)-11-(furan-3-yl)-13-methyl-7,8,11,12-tetrahydro-6H,9aH-8,12a-methanofuro[3',2':6,7]oxepino[4,5-d]isobenzofuran-4(12bH)-one structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (6aS,8R,9aR,11R,12aS,12bR,13S)-11-(furan-3-yl)-13-methyl-7,8,11,12-tetrahydro-6H,9aH-8,12a-methanofuro[3',2':6,7]oxepino[4,5-d]isobenzofuran-4(12bH)-one |
|---|---|
| IUPAC Name | (6aS,8R,9aR,11R,12aS,12bR,13S)-11-(furan-3-yl)-13-methyl-7,8,11,12-tetrahydro-6H,9aH-8,12a-methanofuro[3',2':6,7]oxepino[4,5-d]isobenzofuran-4(12bH)-one |
| Molecular Formula | C20H20O5 |
| Molecular Weight | 340.38 |
| SMILES | C[C@@H]1[C@H]2C[C@@]34COC(=O)C3=CC=C[C@H]4[C@@]13C[C@H](C1=COC=C1)O[C@H]3O2 |
| InChI Key | HIKUAKUTPBLJKQ-JSLAWISBSA-N |
| Synonym | (2R,9aS,13S)-2α-(3-Furanyl)-2,3,10,11-tetrahydro-13-methyl-12aαH-3aα,11α-methanodifuro[3,2-a:3',4'-f][3]benzoxepin-7(3bαH)-one;Salvifaricin |
| CAS No. | 87321-87-7 |
Synthetic Route by SureRoute
2. ACEXEO583 Molecular Building Block Synthetic Route
methyl (1S,4R,5S,5aS,9aR)-5-((R)-2-(furan-3-yl)-2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)ethyl)-5,9a-dimethyl-3-oxo-1,3,4,5,5a,6,7,9a-octahydro-1,4-methanobenzo[c]oxepine-9-carboxylate
methyl (1S,4R,5S,5aS,9aR)-5-((R)-2-(furan-3-yl)-2-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)ethyl)-5,9a-dimethyl-3-oxo-1,3,4,5,5a,6,7,9a-octahydro-1,4-methanobenzo[c]oxepine-9-carboxylate
methyl (2S,5aS,9aR,9bS)-2-(furan-3-yl)-10-methylene-5-oxo-1,2,9,9a-tetrahydro-3aH,5H,8H-5a,9b-propanofuro[2,3-c]isochromene-6-carboxylate