TPCN00479
![[object Object]](../../static/browser_molecular_png/TPCN00479.png)
| Name | Paeonihybridin |
| Molecular Formula | C41H50O21 |
| Molecular Weight | 878.83 |
| CAS Registry Number | 1037683-12-7 |
| SMILES | CC12CC3(O)OC(O1)C1(COC(=O)c4ccccc4)C3CC21OC1OC2COC(c3ccccc3OC3OC(COC4OCC(O)C(O)C4O)C(O)C(O)C3O)OC2C(O)C1O |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Paeoniaceae | Paeonia hybrida | Roots | 0.000227% | Phytochemistry, 2008, 69, 1767-1772. | 10.1016/j.phytochem.2008.02.016 |
Properties
| HBA | 21 | HBD | 9 |
| HeavyAtoms | 62 | AlogP | -2.95 |
| TPSA | 300.67 | RotatableBonds | 11 |
| FractionCSP3 | 0.68 | Rings | 12 |
| AromaticRings | 2 | AliphaticRings | 10 |