Account (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
- Catalog No. :
- ACGXMQ375
- CAS No. :
- 22961-68-8
- Molecular Formula :
- C29H46O8
- Molecular Weight :
- 522.68
IUPAC Name:(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
![(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 structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (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 |
|---|---|
| IUPAC Name | (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 |
| MDL No. | MFCD32197367 |
| Molecular Formula | C29H46O8 |
| Molecular Weight | 522.68 |
| SMILES | CC(=O)O[C@@H]1C[C@H]2C(=O)C=C3[C@H](CC[C@]4(C)[C@@H]([C@@](C)(O)[C@H](O)CCC(C)(C)O)CC[C@@]34O)[C@@]2(C)C[C@@H]1O |
| InChI Key | UWFCFVQTAHITKV-OQQOFWQASA-N |
| Synonym | 20-hydroxyecdysone 3-acetate,d;20-hydroxyecdysone 3-acetate;3-O-Acetyl-20-hydroxyecdysone;Cholest-7-en-6-one, 3-(acetyloxy)-2,14,20,22,25-pentahydroxy-, (2β,3β,5β,22R)-;β-Ecdysone 3-acetate;Inhibitor,3 O Acetyl 20 Hydroxyecdysone,3OAcetyl20Hydroxyecdysone,inhibit;20-Hydroxyecdysone 3-acetate/β-Ecdysone 3-acetate;3-O-Acetyl-20-Hydroxyecdysone, 10 mM in DMSO |
| CAS No. | 22961-68-8 |
Synthetic Route by SureRoute
2. ACGXMQ375 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,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
(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