TPCN04342
![[object Object]](../../static/browser_molecular_png/TPCN04342.png)
| Name | Bupleuroside III |
| Molecular Formula | C42H70O14 |
| Molecular Weight | 799.01 |
| CAS Registry Number | 173559-73-4 |
| SMILES | CC1OC(OC2CCC3(C)C(CCC4(C)C3C(O)C=C3C5CC(C)(C)CCC5(CO)C(O)CC34C)C2(C)CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apiaceae | Pleurospermum kamtschaticum | Aerial parts | 0.001350% | Chem Pharm Bull (Tokyo) 60(8): 1011-1018. | 10.1248/cpb.c12-00274 |
Properties
| HBA | 14 | HBD | 10 |
| HeavyAtoms | 56 | AlogP | 0.73 |
| TPSA | 239.22 | RotatableBonds | 7 |
| FractionCSP3 | 0.95 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |