Account Yunaconitoline
- Catalog No. :
- ACZVHC009
- CAS No. :
- 259099-25-7
- Molecular Formula :
- C34H43NO10
- Molecular Weight :
- 625.72
IUPAC Name:(3R,6aR,7R,7aR,8R,9S,10S,11aR,12R,12aR,13R,14S)-11a-acetoxy-1-ethyl-9-hydroxy-10,13-dimethoxy-3-(methoxymethyl)-4-oxo-1,3,4,7,7a,8,9,10,11,11a,12,12a-dodecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl 4-methoxybenzoate
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Product Information
| Product Name | Yunaconitoline |
|---|---|
| IUPAC Name | (3R,6aR,7R,7aR,8R,9S,10S,11aR,12R,12aR,13R,14S)-11a-acetoxy-1-ethyl-9-hydroxy-10,13-dimethoxy-3-(methoxymethyl)-4-oxo-1,3,4,7,7a,8,9,10,11,11a,12,12a-dodecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl 4-methoxybenzoate |
| Molecular Formula | C34H43NO10 |
| Molecular Weight | 625.72 |
| SMILES | CCN1C[C@]2(COC)C(=O)C=C[C@@]34[C@@H]5C[C@]6(O)[C@@H](OC)C[C@@](OC(C)=O)([C@H]5[C@H]6OC(=O)C5=CC=C(OC)C=C5)[C@@H]([C@H](OC)[C@H]23)[C@@H]14 |
| InChI Key | SHTGLCWQWPWURU-QSJNBHOQSA-N |
| Synonym | Yunaconitoline;Aconitan-3-one, 8-(acetyloxy)-1,2-didehydro-20-ethyl-13-hydroxy-6,16-dimethoxy-14-[(4-methoxybenzoyl)oxy]-4-(methoxymethyl)-, (6α,14α,16β)- (9CI) |
| CAS No. | 259099-25-7 |
Synthetic Route by SureRoute
2. ACZVHC009 Molecular Building Block Synthetic Route
11a-acetoxy-1-ethyl-9-hydroxy-6,10,13-trimethoxy-3-(methoxymethyl)tetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl 4-methoxybenzoate
11a-acetoxy-1-ethyl-4,9-dihydroxy-6,10,13-trimethoxy-3-(methoxymethyl)tetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl 4-methoxybenzoate
(3R,4R,6S,6aS,7R,7aR,8R,9S,10S,11aR,12aR,13R,14S)-1-ethyl-9-hydroxy-6,10,13-trimethoxy-8-((4-methoxybenzoyl)oxy)-3-(methoxymethyl)tetradecahydro-11aH-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocine-4,11a-diyl diacetate