Account (1S,4aR,5S,6R,6aS,7S,11aS,11bS)-4a,7-dihydroxy-4,4,7,11b-tetramethyl-9-oxo-1,2,3,4,4a,5,6,6a,7,9,11a,11b-dodecahydrophenanthro[3,2-b]furan-1,5,6-triyl triacetate
- Catalog No. :
- ACKUIN028
- CAS No. :
- 1053189-53-9
- Molecular Formula :
- C26H34O10
- Molecular Weight :
- 506.55
IUPAC Name:(1S,4aR,5S,6R,6aS,7S,11aS,11bS)-4a,7-dihydroxy-4,4,7,11b-tetramethyl-9-oxo-1,2,3,4,4a,5,6,6a,7,9,11a,11b-dodecahydrophenanthro[3,2-b]furan-1,5,6-triyl triacetate
![(1S,4aR,5S,6R,6aS,7S,11aS,11bS)-4a,7-dihydroxy-4,4,7,11b-tetramethyl-9-oxo-1,2,3,4,4a,5,6,6a,7,9,11a,11b-dodecahydrophenanthro[3,2-b]furan-1,5,6-triyl triacetate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (1S,4aR,5S,6R,6aS,7S,11aS,11bS)-4a,7-dihydroxy-4,4,7,11b-tetramethyl-9-oxo-1,2,3,4,4a,5,6,6a,7,9,11a,11b-dodecahydrophenanthro[3,2-b]furan-1,5,6-triyl triacetate |
|---|---|
| IUPAC Name | (1S,4aR,5S,6R,6aS,7S,11aS,11bS)-4a,7-dihydroxy-4,4,7,11b-tetramethyl-9-oxo-1,2,3,4,4a,5,6,6a,7,9,11a,11b-dodecahydrophenanthro[3,2-b]furan-1,5,6-triyl triacetate |
| MDL No. | MFCD28385962 |
| Molecular Formula | C26H34O10 |
| Molecular Weight | 506.55 |
| SMILES | CC(=O)O[C@@H]1[C@@H]2[C@H](C=C3OC(=O)C=C3[C@@]2(C)O)[C@@]2(C)[C@@H](OC(C)=O)CCC(C)(C)[C@]2(O)[C@H]1OC(C)=O |
| InChI Key | XKLBSFHFNUCCKY-UXYMEOMDSA-N |
| Synonym | Neocaesalpin O;Phenanthro[3,2-b]furan-9(1H)-one, 1,5,6-tris(acetyloxy)-2,3,4,4a,5,6,6a,7,11a,11b-decahydro-4a,7-dihydroxy-4,4,7,11b-tetramethyl-, (1S,4aR,5S,6R,6aS,7S,11aS,11bS)- |
| CAS No. | 1053189-53-9 |
Synthetic Route by SureRoute
2. ACKUIN028 Molecular Building Block Synthetic Route
(1aS,3aR,7aR,7bS,11bR)-4,4,7a,11-tetramethyl-3,3a,4,5,6,7,7a,7b-octahydro-2H-oxireno[2',3':1,10a]phenanthro[3,2-b]furan-10(11bH)-one
(4R,4aS,5aS,6aR,6bS)-3,6b-dimethyl-5-methylene-2-oxo-2,4,4a,5,5a,6,6a,6b-octahydrocyclopropa[2,3]indeno[5,6-b]furan-4-yl acetate
(4aR,5S,7aR,8R)-5,7a,8-trihydroxy-3,5,8-trimethyl-4a,5,6,7,7a,8-hexahydroazuleno[6,5-b]furan-2(4H)-one