Account (2S,3R,5R,9R,10R,11R,13R,14S,17S)-17-((2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl)-3,11,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl acetate
- Catalog No. :
- ACXSOH603
- CAS No. :
- 154510-93-7
- Molecular Formula :
- C29H46O8
- Molecular Weight :
- 522.68
IUPAC Name:(2S,3R,5R,9R,10R,11R,13R,14S,17S)-17-((2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl)-3,11,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl acetate
![(2S,3R,5R,9R,10R,11R,13R,14S,17S)-17-((2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl)-3,11,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl acetate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (2S,3R,5R,9R,10R,11R,13R,14S,17S)-17-((2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl)-3,11,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl acetate |
|---|---|
| IUPAC Name | (2S,3R,5R,9R,10R,11R,13R,14S,17S)-17-((2R,3R)-2,3-dihydroxy-6-methylheptan-2-yl)-3,11,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl acetate |
| Molecular Formula | C29H46O8 |
| Molecular Weight | 522.68 |
| SMILES | CC(=O)O[C@H]1C[C@]2(C)[C@@H]3C(=CC(=O)[C@@H]2C[C@H]1O)[C@]1(O)CC[C@H]([C@@](C)(O)[C@H](O)CCC(C)C)[C@@]1(C)C[C@H]3O |
| InChI Key | OJHBARZZNBDVOD-FKKYEMARSA-N |
| Synonym | Cholest-7-en-6-one, 2-(acetyloxy)-3,11,14,20,22-pentahydroxy-, (2β,3β,5β,11α,22R)-;Ajugasterone C 2-acetate |
| CAS No. | 154510-93-7 |
Synthetic Route by SureRoute
2. ACXSOH603 Molecular Building Block Synthetic Route
(2S,3R,5R,9R,10R,13R,14S,17S)-3,14-dihydroxy-10,13-dimethyl-6-oxo-17-((2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl)-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-2-yl acetate
(2S,3R,5R,9R,10R,13R,14S,17S)-2,14-dihydroxy-10,13-dimethyl-6-oxo-17-((2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl)-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate
(3S,4S,6R)-6-((R)-1-hydroxy-1-((2S,3R,5R,9R,10R,13R,14S,17S)-2,3,14-trihydroxy-10,13-dimethyl-6-oxo-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)ethyl)-4-((R)-1-hydroxyethyl)-3-methyltetrahydro-2H-pyran-2-one