Account (2S,4aS,6S,6aS,7R,10R,11aR,11bS)-2-(furan-3-yl)-11b-methyl-4,8-dioxododecahydro-2H-7,10-methanooxepino[4,5-f]isochromen-6-yl (E)-3-(4-methoxyphenyl)acrylate
- Catalog No. :
- ACUAYF942
- CAS No. :
- 1187951-05-8
- Molecular Formula :
- C29H30O8
- Molecular Weight :
- 506.55
IUPAC Name:(2S,4aS,6S,6aS,7R,10R,11aR,11bS)-2-(furan-3-yl)-11b-methyl-4,8-dioxododecahydro-2H-7,10-methanooxepino[4,5-f]isochromen-6-yl (E)-3-(4-methoxyphenyl)acrylate
![(2S,4aS,6S,6aS,7R,10R,11aR,11bS)-2-(furan-3-yl)-11b-methyl-4,8-dioxododecahydro-2H-7,10-methanooxepino[4,5-f]isochromen-6-yl (E)-3-(4-methoxyphenyl)acrylate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (2S,4aS,6S,6aS,7R,10R,11aR,11bS)-2-(furan-3-yl)-11b-methyl-4,8-dioxododecahydro-2H-7,10-methanooxepino[4,5-f]isochromen-6-yl (E)-3-(4-methoxyphenyl)acrylate |
|---|---|
| IUPAC Name | (2S,4aS,6S,6aS,7R,10R,11aR,11bS)-2-(furan-3-yl)-11b-methyl-4,8-dioxododecahydro-2H-7,10-methanooxepino[4,5-f]isochromen-6-yl (E)-3-(4-methoxyphenyl)acrylate |
| Molecular Formula | C29H30O8 |
| Molecular Weight | 506.55 |
| SMILES | COC1=CC=C(/C=C/C(=O)O[C@H]2C[C@@H]3C(=O)O[C@H](C4=COC=C4)C[C@@]3(C)[C@@H]3C[C@@H]4C[C@@H](C(=O)O4)[C@@H]23)C=C1 |
| InChI Key | NFXKFVAWBBOWIJ-WBQZIMCXSA-N |
| Synonym | Diosbulbin I;2-Propenoic acid, 3-(4-methoxyphenyl)-, (2S,4aS,6S,6aS,7R,10R,11aR,11bS)-2-(3-furanyl)dodecahydro-11b-methyl-4,8-dioxo-7,10-methano-2H-pyrano[4,3-g][3]benzoxepin-6-yl ester, (2E)-;(1R,2S,3S,5S,8S,11R,13R)-8-(3-Furyl)-10-methyl-6,15-dioxo-7,14-dioxatetracyclo[11.2.1.0sup2,11sup.0sup5,10sup]hexadec-3-yl(2E)-3-(4-methoxyphenyl)acrylate |
| CAS No. | 1187951-05-8 |
Synthetic Route by SureRoute
2. ACUAYF942 Molecular Building Block Synthetic Route
9-(furan-3-yl)-2-hydroxy-10a-methyldodecahydro-4H,7H-isobenzofuro[7,1-fg]isochromene-4,7-dione
(2S,4aR,6S,6aS,7R,10R,11aR,11bS)-2-(Furan-3-yl)-11b-methyl-4,8-dioxododecahydro-1H-7,10-methanooxepino[4,5-f]isochromen-6-yl acetate
2-(Furan-3-yl)-6-hydroxy-11b-methyldecahydro-4H-7,10-methanooxepino[4,5-f]isochromene-4,8(4aH)-dione