Account Asperulosidic acid
- Catalog No. :
- ACRNPQ094
- CAS No. :
- 25368-11-0
- Molecular Formula :
- C18H24O12
- Molecular Weight :
- 432.38
IUPAC Name:(1S,4aS,5S,7aS)-7-(acetoxymethyl)-5-hydroxy-1-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
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Product Information
| Product Name | Asperulosidic acid |
|---|---|
| IUPAC Name | (1S,4aS,5S,7aS)-7-(acetoxymethyl)-5-hydroxy-1-((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid |
| MDL No. | - |
| Molecular Formula | C18H24O12 |
| Molecular Weight | 432.38 |
| SMILES | CC(OCC1=C[C@@H]([C@@]2([H])[C@]1([H])[C@@H](OC=C2C(O)=O)OC3C(O)C(O)C(O)C(CO)O3)O)=O |
| InChI Key | DGDWCRWJRNMRKX-GRSPEYSNSA-N |
| Synonym | (1S,4aS,5S,7aS)-7-(acetyloxymethyl)-5-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid | BDBM50202632 | CS-0032781 | AC-34118 | CYCLOPENTA(C)PYRAN-4-CARBOXYLIC ACID, 7-((A |
| CAS No. | 25368-11-0 |
| PubChem CID | 11968867 |
Safety Data
- Pictogram
- Signal Word
- Warning
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Synthetic Route by SureRoute
2. ACRNPQ094 Molecular Building Block Synthetic Route
Asperulosidic acid methyl ester
(1S,4aS,5S,7aS)-5-Hydroxy-7-(hydroxymethyl)-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid
(1S,4aS,5R,7aS)-5-hydroxy-7-(hydroxymethyl)-1-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylic acid