Products 1016987-87-3
CAS 1016987-87-3 appears in our catalog under these names: 6-o-p-Hydroxybenzoylaucubin, Derwentioside B. Offered by: Biosynth, MedChemExpress. Available pack sizes: 5mg, 10mg, 25mg, 50mg, Get quote.
[(1S,4aR,5S,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl] 4-hydroxybenzoate (CAS 1016987-87-3) is a chemical compound with the molecular formula C22H26O11 and a molecular weight of 466.4 g/mol. IUPAC name: [(1S,4aR,5S,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl] 4-hydroxybenzoate. InChIKey: JZWZFNOVWZEQMF-QNAXTHAFSA-N.
| Molecular formula | C22H26O11 |
|---|---|
| Molecular weight | 466.4 g/mol |
| IUPAC name | [(1S,4aR,5S,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-5-yl] 4-hydroxybenzoate |
| InChIKey | JZWZFNOVWZEQMF-QNAXTHAFSA-N |
| SMILES | C1=CO[C@H]([C@H]2[C@@H]1[C@@H](C=C2CO)OC(=O)C3=CC=C(C=C3)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
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