Account Ajugoside
- Catalog No. :
- ACYJCV355
- CAS No. :
- 52916-96-8
- Molecular Formula :
- C17H26O10
- Molecular Weight :
- 390.39
IUPAC Name:(1S,4aR,5R,7S,7aS)-5-hydroxy-7-methyl-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-7-yl acetate
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Product Information
| Product Name | Ajugoside |
|---|---|
| IUPAC Name | (1S,4aR,5R,7S,7aS)-5-hydroxy-7-methyl-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-7-yl acetate |
| Molecular Formula | C17H26O10 |
| Molecular Weight | 390.39 |
| SMILES | CC(=O)O[C@@]1(C)C[C@@H](O)[C@@H]2C=CO[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]21 |
| InChI Key | FLOXQRMTDDOZKF-MUIWGTDSSA-N |
| Synonym | Ajugoside;(1S)-7α-Acetoxy-1α-(β-D-glucopyranosyloxy)-1,4aα,5,6,7,7aα-hexahydro-7-methylcyclopenta[c]pyran-5α-ol;[(1S)-7α-Acetoxy-1,4aα,5,6,7,7aα-hexahydro-5α-hydroxy-7-methylcyclopenta[c]pyran-1α-yl]β-D-glucopyranoside;β-D-Glucopyranoside, (1S,4aR,5R,7S,7aS)-7-(acetyloxy)-1,4a,5,6,7,7a-hexahydro-5-hydroxy-7-methylcyclopenta[c]pyran-1-yl |
| CAS No. | 52916-96-8 |
Synthetic Route by SureRoute
2. ACYJCV355 Molecular Building Block Synthetic Route
Rehmannioside C
(1S,4aS,5R,7S,7aS)-4a,5-Dihydroxy-7-methyl-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-7-yl acetate
4a,5-dihydroxy-7-methyl-1-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-7-yl acetate