Account 3-((E)-2-((1R,4aS,5R,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylene-5-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)decahydronaphthalen-1-yl)vinyl)furan-2(5H)-one
- Catalog No. :
- ACJJDR745
- CAS No. :
- 141973-41-3
- Molecular Formula :
- C26H38O9
- Molecular Weight :
- 494.58
IUPAC Name:3-((E)-2-((1R,4aS,5R,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylene-5-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)decahydronaphthalen-1-yl)vinyl)furan-2(5H)-one
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Product Information
| Product Name | 3-((E)-2-((1R,4aS,5R,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylene-5-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)decahydronaphthalen-1-yl)vinyl)furan-2(5H)-one |
|---|---|
| IUPAC Name | 3-((E)-2-((1R,4aS,5R,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylene-5-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)decahydronaphthalen-1-yl)vinyl)furan-2(5H)-one |
| MDL No. | MFCD23103731 |
| Molecular Formula | C26H38O9 |
| Molecular Weight | 494.58 |
| SMILES | C=C1CC[C@@H]2[C@](C)(CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)CC[C@@]2(C)[C@@H]1/C=C/C1=CCOC1=O |
| InChI Key | MWGVWTQBNFFGTG-XCMZMCRNSA-N |
| Synonym | 14-DEOXY-11,12-DIDEHYDROANDROGRA;14-Deoxy-11,12-didehydroandrographiside;4-[(E)-2-[(1R,4aS,5R,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]ethenyl]-2H-furan-5-one;2(5H)-Furanone, 3-[(1E)-2-[(1R,4aS,5R,6R,8aR)-5-[(β-D-glucopyranosyloxy)methyl]decahydro-6-hydroxy-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethenyl]- |
| CAS No. | 141973-41-3 |
Synthetic Route by SureRoute
2. ACJJDR745 Molecular Building Block Synthetic Route
3-(2-((1R,4aS,5R,6R,8aS)-6-hydroxy-5,8a-dimethyl-2-methylene-5-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)decahydronaphthalen-1-yl)ethyl)furan-2(5H)-one
3-(2-((1R,4aS,5R,8aS)-5,8a-Dimethyl-2-methylene-5-((((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)decahydronaphthalen-1-yl)ethyl)furan-2(5H)-one
4-(((1R,2R,4aR,5R,8aS)-2-((3-Carboxypropanoyl)oxy)-1,4a-dimethyl-6-methylene-5-((E)-2-(2-oxo-2,5-dihydrofuran-3-yl)vinyl)decahydronaphthalen-1-yl)methoxy)-4-oxobutanoic acid