TPCN00662
![[object Object]](../../static/browser_molecular_png/TPCN00662.png)
| Name | 4-O-Methylsuffrupaeoniflorin B |
| Molecular Formula | C32H36O13 |
| Molecular Weight | 628.63 |
| CAS Registry Number | 1515943-40-4 |
| SMILES | COc1ccc(C(=O)OCC23C4OC5(OC)CC(C)(O4)C2(OC2OC(COC(=O)c4ccccc4)C(O)C(O)C2O)CC53)cc1 |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Paeoniaceae | Paeonia suffruticosa | Barks | 0.000065% | Chem Pharm Bull (Tokyo), 2003, 51, 58-61. | 10.1021/np400571x |
Properties
| HBA | 13 | HBD | 3 |
| HeavyAtoms | 45 | AlogP | 1.17 |
| TPSA | 168.67 | RotatableBonds | 10 |
| FractionCSP3 | 0.56 | Rings | 9 |
| AromaticRings | 2 | AliphaticRings | 7 |