Account (3R,4R,6S,7R,7aR,8R,9R,10S,11S,11aR,13R,14S)-4,9,11,11a-Tetrahydroxy-6,10,13-trimethoxy-3-(methoxymethyl)-1-methyltetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl benzoate
- Catalog No. :
- ACITSA556
- CAS No. :
- 63238-67-5
- Molecular Formula :
- C31H43NO10
- Molecular Weight :
- 589.68
IUPAC Name:(3R,4R,6S,7R,7aR,8R,9R,10S,11S,11aR,13R,14S)-4,9,11,11a-tetrahydroxy-6,10,13-trimethoxy-3-(methoxymethyl)-1-methyltetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl benzoate
![(3R,4R,6S,7R,7aR,8R,9R,10S,11S,11aR,13R,14S)-4,9,11,11a-Tetrahydroxy-6,10,13-trimethoxy-3-(methoxymethyl)-1-methyltetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl benzoate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (3R,4R,6S,7R,7aR,8R,9R,10S,11S,11aR,13R,14S)-4,9,11,11a-Tetrahydroxy-6,10,13-trimethoxy-3-(methoxymethyl)-1-methyltetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl benzoate |
|---|---|
| IUPAC Name | (3R,4R,6S,7R,7aR,8R,9R,10S,11S,11aR,13R,14S)-4,9,11,11a-tetrahydroxy-6,10,13-trimethoxy-3-(methoxymethyl)-1-methyltetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl benzoate |
| MDL No. | - |
| Molecular Formula | C31H43NO10 |
| Molecular Weight | 589.68 |
| SMILES | COC[C@]12CN(C)C3C4[C@H](OC)[C@H]1C3([C@@H](OC)C[C@H]2O)[C@@H]1C[C@@]2(O)[C@H](OC(=O)C3=CC=CC=C3)[C@@H]1[C@]4(O)[C@@H](O)[C@@H]2OC |
| InChI Key | PULWZCUZNRVAHT-JQGYJHISSA-N |
| Synonym | Mesaconine 14-benzoate |
| CAS No. | 63238-67-5 |
| PubChem CID | 24832659 |
Synthetic Route by SureRoute
2. ACITSA556 Molecular Building Block Synthetic Route
(3S,6S,7S,7aR,8R,9S,10S,11S,11aR,13R,14R)-9,11,11a-trihydroxy-6,10,13-trimethoxy-3-(methoxymethyl)-1-methyltetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl benzoate
1-ethyl-4,9,11a-trihydroxy-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 benzoate
(3R,4R,6S,6aS,7R,7aR,8R,9S,10S,11S,11aR,12S,12aR,13R,14S)-1-ethyl-4,9,11-trihydroxy-6,10,11a,13-tetramethoxy-3-(methoxymethyl)tetradecahydro-2H-3,6a,12-(epiethane[1,1,2]triyl)-7,9-methanonaphtho[2,3-b]azocin-8-yl benzoate