Account (3R,3'R,4S,4'S,5S,5'S,6S,6'S)-2,3,3',4,4',5,5'-Heptahydroxy-2'-((5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)octahydro-2H,2'H-[2,2'-bipyran]-6,6'-dicarboxylic acid
- Catalog No. :
- ACYKDT015
- CAS No. :
- 74696-01-8
- Molecular Formula :
- C27H26O18
- Molecular Weight :
- 638.49
IUPAC Name:(3R,3'R,4S,4'S,5S,5'S,6S,6'S)-2,3,3',4,4',5,5'-heptahydroxy-2'-((5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)octahydro-2H,2'H-[2,2'-bipyran]-6,6'-dicarboxylic acid
![(3R,3'R,4S,4'S,5S,5'S,6S,6'S)-2,3,3',4,4',5,5'-Heptahydroxy-2'-((5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)octahydro-2H,2'H-[2,2'-bipyran]-6,6'-dicarboxylic acid structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | (3R,3'R,4S,4'S,5S,5'S,6S,6'S)-2,3,3',4,4',5,5'-Heptahydroxy-2'-((5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)octahydro-2H,2'H-[2,2'-bipyran]-6,6'-dicarboxylic acid |
|---|---|
| IUPAC Name | (3R,3'R,4S,4'S,5S,5'S,6S,6'S)-2,3,3',4,4',5,5'-heptahydroxy-2'-((5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)octahydro-2H,2'H-[2,2'-bipyran]-6,6'-dicarboxylic acid |
| Molecular Formula | C27H26O18 |
| Molecular Weight | 638.49 |
| SMILES | O=C(O)[C@H]1OC(O)(C2(OC3=CC4=C(C(O)=C3)C(=O)C=C(C3=CC=C(O)C=C3)O4)O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O |
| InChI Key | DNLWBUYPANAAEB-OVQLGBADSA-N |
| Synonym | APIGENIN-7-DIGLUCURONIDE |
| CAS No. | 74696-01-8 |
Synthetic Route by SureRoute
2. ACYKDT015 Molecular Building Block Synthetic Route
Clerodendrin
(2S,3S,4S,5R,6R)-6-(((2S,3R,4S,5S,6R)-4,5-dihydroxy-2-((5-hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid
(2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-((5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid