Account Mudanpioside H
- Catalog No. :
- ACLKAP097
- CAS No. :
- 231280-71-0
- Molecular Formula :
- C30H32O14
- Molecular Weight :
- 616.57
IUPAC Name:((1aR,1a1S,2R,3aR,5S,5aR)-2-hydroxy-5-methyl-5a-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(((4-hydroxybenzoyl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-1H-3,4-dioxa-2,5-methanocyclobuta[cd]pentalen-1a1(3aH)-yl)methyl 4-hydroxybenzoate
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Product Information
| Product Name | Mudanpioside H |
|---|---|
| IUPAC Name | ((1aR,1a1S,2R,3aR,5S,5aR)-2-hydroxy-5-methyl-5a-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(((4-hydroxybenzoyl)oxy)methyl)tetrahydro-2H-pyran-2-yl)oxy)tetrahydro-1H-3,4-dioxa-2,5-methanocyclobuta[cd]pentalen-1a1(3aH)-yl)methyl 4-hydroxybenzoate |
| MDL No. | MFCD32644897 |
| Molecular Formula | C30H32O14 |
| Molecular Weight | 616.57 |
| SMILES | O[C@H]([C@H]([C@@H]([C@@H](COC(C1=CC=C(O)C=C1)=O)O2)O)O)[C@@H]2O[C@@]3(C4)[C@@](C5)(C)O[C@]6([H])O[C@@]5(O)[C@@]4([H])[C@]36COC(C7=CC=C(O)C=C7)=O |
| InChI Key | ICDRIPCQQSUIDZ-HRCYFWENSA-N |
| Synonym | Mudanpioside H;β-D-Glucopyranoside, (1aR,2S,3aR,5R,5aR,5bS)-tetrahydro-5-hydroxy-5b-[[(4-hydroxybenzoyl)oxy]methyl]-2-methyl-2,5-methano-1H-3,4-dioxacyclobuta[cd]pentalen-1a(2H)-yl, 6-(4-hydroxybenzoate) |
| CAS No. | 231280-71-0 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P305+P351+P338
Synthetic Route by SureRoute
2. ACLKAP097 Molecular Building Block Synthetic Route
((2R,3S,4S,5R,6S)-6-(((1aR,1a1S,2R,5S,5aR)-1a1-((benzoyloxy)methyl)-2-hydroxy-5-methyltetrahydro-1H-3,4-dioxa-2,5-methanocyclobuta[cd]pentalen-5a(5H)-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)methyl 4-hydroxybenzoate
((1aR,1a1S,2R,3aR,5S,5aR)-5a-(((2S,3R,4S,5S,6R)-6-((benzoyloxy)methyl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)oxy)-2-hydroxy-5-methyltetrahydro-1H-3,4-dioxa-2,5-methanocyclobuta[cd]pentalen-1a1(3aH)-yl)methyl 4-hydroxybenzoate
Benzoylpaeoniflorin