Products 39012-20-9
CAS 39012-20-9 appears in our catalog under these names: Picroside II, Picroside II, >95% (HPLC), Picroside II/ 99.83% (existing batch purity), Picroside II, >98.0%(HPLC)(qNMR), Picroside 2, 98.00%. Offered by: GLPBio, TRC, TargetMol, TCI, Chemat. Available pack sizes: 20mg, 10mg, 10mM (in 1ml dmso), 5mg, 25mg, 50mg, 100mg, 500mg.
[(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxy-3-methoxybenzoate (CAS 39012-20-9) is a chemical compound with the molecular formula C23H28O13 and a molecular weight of 512.5 g/mol. IUPAC name: [(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxy-3-methoxybenzoate. InChIKey: AKNILCMFRRDTEY-NUGKWEEESA-N.
| Molecular formula | C23H28O13 |
|---|---|
| Molecular weight | 512.5 g/mol |
| IUPAC name | [(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxy-3-methoxybenzoate |
| InChIKey | AKNILCMFRRDTEY-NUGKWEEESA-N |
| SMILES | COC1=C(C=CC(=C1)C(=O)O[C@H]2[C@@H]3C=CO[C@H]([C@@H]3[C@@]4([C@H]2O4)CO)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O |
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