TPCN00818
![[object Object]](../../static/browser_molecular_png/TPCN00818.png)
| Name | 4-O-methyl-4??-hydroxy-3??-methoxy-paeoniflorin |
| Molecular Formula | C25H32O13 |
| Molecular Weight | 540.52 |
| CAS Registry Number | 945467-82-3 |
| SMILES | COc1cc(C(=O)OCC23C4OC5(OC)CC(C)(O4)C2(OC2OC(CO)C(O)C(O)C2O)CC53)ccc1O |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Paeoniaceae | Paeonia delavayi | Roots | 0.002100% | Fitoterapia, 2007, 78, 76-78. | 10.1016/j.fitote.2006.09.014 |
Properties
| HBA | 13 | HBD | 5 |
| HeavyAtoms | 38 | AlogP | -0.99 |
| TPSA | 182.83 | RotatableBonds | 8 |
| FractionCSP3 | 0.72 | Rings | 8 |
| AromaticRings | 1 | AliphaticRings | 7 |