Account 4-((3aR,4aS,8S,10aS,10bR,12aR)-8-(((2R,3R,4S,5S,6R)-3-hydroxy-4-methoxy-6-methyl-5-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-10a,12a-dimethyl-5,6,6a,7,8,9,10,10a,10b,11,12,12a-dodecahydro-3H-cyclopenta[1,2]phenanthro[1,10a-b]oxiren-1-yl)furan-2(5H)-one
- Catalog No. :
- ACHRTA298
- CAS No. :
- 144223-70-1
- Molecular Formula :
- C36H52O13
- Molecular Weight :
- 692.80
IUPAC Name:4-((3aR,4aS,8S,10aS,10bR,12aR)-8-(((2R,3R,4S,5S,6R)-3-hydroxy-4-methoxy-6-methyl-5-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-10a,12a-dimethyl-5,6,6a,7,8,9,10,10a,10b,11,12,12a-dodecahydro-3H-cyclopenta[1,2]phenanthro[1,10a-b]oxiren-1-yl)furan-2(5H)-one
![4-((3aR,4aS,8S,10aS,10bR,12aR)-8-(((2R,3R,4S,5S,6R)-3-hydroxy-4-methoxy-6-methyl-5-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-10a,12a-dimethyl-5,6,6a,7,8,9,10,10a,10b,11,12,12a-dodecahydro-3H-cyclopenta[1,2]phenanthro[1,10a-b]oxiren-1-yl)furan-2(5H)-one structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 4-((3aR,4aS,8S,10aS,10bR,12aR)-8-(((2R,3R,4S,5S,6R)-3-hydroxy-4-methoxy-6-methyl-5-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-10a,12a-dimethyl-5,6,6a,7,8,9,10,10a,10b,11,12,12a-dodecahydro-3H-cyclopenta[1,2]phenanthro[1,10a-b]oxiren-1-yl)furan-2(5H)-one |
|---|---|
| IUPAC Name | 4-((3aR,4aS,8S,10aS,10bR,12aR)-8-(((2R,3R,4S,5S,6R)-3-hydroxy-4-methoxy-6-methyl-5-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-10a,12a-dimethyl-5,6,6a,7,8,9,10,10a,10b,11,12,12a-dodecahydro-3H-cyclopenta[1,2]phenanthro[1,10a-b]oxiren-1-yl)furan-2(5H)-one |
| MDL No. | MFCD20274967 |
| Molecular Formula | C36H52O13 |
| Molecular Weight | 692.80 |
| SMILES | CO[C@H]1[C@@H](O)[C@H](O[C@H]2CC[C@@]3(C)C(CC[C@@]45O[C@@]46CC=C(C4=CC(=O)OC4)[C@@]6(C)CC[C@H]35)C2)O[C@H](C)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| InChI Key | ULJZNLQMTRZTJF-WPBYJKQESA-N |
| Synonym | Dehydroadynerigenin glucosyldigitaloside;Carda-16,20(22)-dienolide, 3-[(6-deoxy-4-O-β-D-glucopyranosyl-3-O-methyl-β-D-galactopyranosyl)oxy]-8,14-epoxy-, (3β,5β)-;(3β,5β)-3-[(6-Deoxy-4-O-β-D-glucopyranosyl-3-O-methyl-β-D-galactopyranosyl)oxy]-8,14-epoxycarda-16,20(22)-dienolide |
| CAS No. | 144223-70-1 |
Synthetic Route by SureRoute
2. ACHRTA298 Molecular Building Block Synthetic Route
4-(8-((4-methoxy-6-methyl-5-((3,4,5-trihydroxy-6-(((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-2H-pyran-2-yl)oxy)-10a,12a-dimethyl-5,6,6a,7,8,9,10,10a,10b,11,12,12a-dodecahydro-3H-cyclopenta[1,2]phenanthro[1,10a-b]oxiren-1-yl)furan-2(5H)-one
Dehydroadynerigenin digitaloside
Adynerigenin beta-Neritrioside