Products 122413-01-8
CAS 122413-01-8 appears in our catalog under these names: paederosidic acid methyl ester, Paederosidic acid methyl ester/ 99.67% (existing batch purity), Methyl (1S,4aS,5S,7aS)-5-hydroxy-7-((((methylthio)carbonyl)oxy)methyl)-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-carboxylate, ≥98%, ≥98%, Paederosidic acid methyl ester, 98.52%. Offered by: GLPBio, TargetMol, Chemat, MedChemExpress. Available pack sizes: 1mg, 10mg, 5mg, 25mg, 5 mg, 10 mg.
Methyl (1S,4aS,5S,7aS)-5-hydroxy-7-(methylsulfanylcarbonyloxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate (CAS 122413-01-8) is a chemical compound with the molecular formula C19H26O12S and a molecular weight of 478.5 g/mol. IUPAC name: methyl (1S,4aS,5S,7aS)-5-hydroxy-7-(methylsulfanylcarbonyloxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate. InChIKey: JNDNZIPLLDTLQK-DILZHRMZSA-N.
| Molecular formula | C19H26O12S |
|---|---|
| Molecular weight | 478.5 g/mol |
| IUPAC name | methyl (1S,4aS,5S,7aS)-5-hydroxy-7-(methylsulfanylcarbonyloxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate |
| InChIKey | JNDNZIPLLDTLQK-DILZHRMZSA-N |
| SMILES | COC(=O)C1=CO[C@H]([C@H]2[C@@H]1[C@H](C=C2COC(=O)SC)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O |
Computed by PubChem (NCBI)