Account Acrihellin
- Catalog No. :
- ACUPTG065
- CAS No. :
- 67696-82-6
- Molecular Formula :
- C29H38O7
- Molecular Weight :
- 498.62
IUPAC Name:(3S,5S,8R,9S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(2-oxo-2H-pyran-5-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl 3-methylbut-2-enoate
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Product Information
| Product Name | Acrihellin |
|---|---|
| IUPAC Name | (3S,5S,8R,9S,10S,13R,14S,17R)-10-formyl-5,14-dihydroxy-13-methyl-17-(2-oxo-2H-pyran-5-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl 3-methylbut-2-enoate |
| Molecular Formula | C29H38O7 |
| Molecular Weight | 498.62 |
| SMILES | CC(C)=CC(O[C@H]1CC[C@]2(C=O)[C@@]3([H])CC[C@]4(C)[C@@H](C5=COC(C=C5)=O)CC[C@]4(O)[C@]3([H])CC[C@]2(O)C1)=O |
| InChI Key | RIOSSPWEPWYRLD-SBQWKNPYSA-N |
| Synonym | acrihellin;5,14-Dihydroxy-3β-[(3-methyl-1-oxo-2-butenyl)oxy]-19-oxo-5β-bufa-20,22-dienolide;Bufa-20,22-dienolide, 5,14-dihydroxy-3-[(3-methyl-1-oxo-2-butenyl)oxy]-19-oxo-, (3β,5β)-;Acrihellinum |
| CAS No. | 67696-82-6 |
Synthetic Route by SureRoute
2. ACUPTG065 Molecular Building Block Synthetic Route
(3S,5S,8R,9S,10S,13R,14S,17R)-3,5,14-trihydroxy-13-methyl-17-(2-oxo-2H-pyran-5-yl)hexadecahydro-10H-cyclopenta[a]phenanthrene-10-carbaldehyde
(3S,5R,8R,9S,10S,11S,13R,14S,17R)-11,14-dihydroxy-10,13-dimethyl-12-oxo-17-(2-oxo-2H-pyran-5-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-3-yl acetate
(3S,5S,8R,9S,10R,13R,14S,16S,17R)-3,5,14-trihydroxy-10,13-dimethyl-17-(2-oxo-2H-pyran-5-yl)hexadecahydro-1H-cyclopenta[a]phenanthren-16-yl acetate