Account (1aR,2R,2aR,2a1R,4aS,5R,9bS,9cS)-2,5-dihydroxy-6-isopropyl-2a,9b-dimethyl-1a,2,2a,2a1,4a,5,9b,9c-octahydro-3H,8H-oxireno[2',3':5,6]isobenzofuro[7,1-fg]isochromene-3,8-dione
- Catalog No. :
- ACYCRO112
- CAS No. :
- 24338-53-2
- Molecular Formula :
- C19H22O7
- Molecular Weight :
- 362.38
IUPAC Name:(1aR,2R,2aR,2a1R,4aS,5R,9bS,9cS)-2,5-dihydroxy-6-isopropyl-2a,9b-dimethyl-1a,2,2a,2a1,4a,5,9b,9c-octahydro-3H,8H-oxireno[2',3':5,6]isobenzofuro[7,1-fg]isochromene-3,8-dione
![(1aR,2R,2aR,2a1R,4aS,5R,9bS,9cS)-2,5-dihydroxy-6-isopropyl-2a,9b-dimethyl-1a,2,2a,2a1,4a,5,9b,9c-octahydro-3H,8H-oxireno[2',3':5,6]isobenzofuro[7,1-fg]isochromene-3,8-dione structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (1aR,2R,2aR,2a1R,4aS,5R,9bS,9cS)-2,5-dihydroxy-6-isopropyl-2a,9b-dimethyl-1a,2,2a,2a1,4a,5,9b,9c-octahydro-3H,8H-oxireno[2',3':5,6]isobenzofuro[7,1-fg]isochromene-3,8-dione |
|---|---|
| IUPAC Name | (1aR,2R,2aR,2a1R,4aS,5R,9bS,9cS)-2,5-dihydroxy-6-isopropyl-2a,9b-dimethyl-1a,2,2a,2a1,4a,5,9b,9c-octahydro-3H,8H-oxireno[2',3':5,6]isobenzofuro[7,1-fg]isochromene-3,8-dione |
| MDL No. | MFCD26406143 |
| Molecular Formula | C19H22O7 |
| Molecular Weight | 362.38 |
| SMILES | CC(C)C1=C2C(=CC(=O)O1)[C@@]1(C)[C@@H]3O[C@@H]3[C@H](O)[C@]3(C)C(=O)O[C@H]([C@@H]2O)[C@@H]31 |
| InChI Key | DGNOPGIIPQKNHD-RSKPZANQSA-N |
| Synonym | NSC 117884;NSC 211500;nagilactone C;(1α,2α,7β)-7-O,8-Seco-8,14-didehydro-15,16-dideoxypodolactone B;3H,8H-Furo[2',3',4':4,5]oxireno[7,8]naphtho[2,1-c]pyran-3,8-dione, 1a,2,2a,4a,4b,5,9b,9c-octahydro-2,5-dihydroxy-2a,9b-dimethyl-6-(1-methylethyl)-, (1aR,2R,2aR,4aS,4bR,5R,9bS,9cS)- |
| CAS No. | 24338-53-2 |
Synthetic Route by SureRoute
2. ACYCRO112 Molecular Building Block Synthetic Route
1β,10β-Epoxy-6β-isobutyryloxy-9-oxofuranoeremophilane
(4bR,8aS,9S,10S)-10-Ethoxy-3,4-dihydroxy-2-isopropyl-8,8-dimethyl-6,7,8,8a,9,10-hexahydro-5H-9,4b-(epoxymethano)phenanthren-12-one
(4bR,8aS,9S,10S)-3,4-dihydroxy-2-isopropyl-10-methoxy-8,8-dimethyl-6,7,8,8a,9,10-hexahydro-5H-9,4b-(epoxymethano)phenanthren-12-one