TPCN04412
![[object Object]](../../static/browser_molecular_png/TPCN04412.png)
| Name | Neocimiside |
| Molecular Formula | C32H48O9 |
| Molecular Weight | 576.73 |
| CAS Registry Number | 161097-79-6 |
| SMILES | CC1CC(=O)C(O)C2(O)CC3(C)C4=CCC5C(C)(C)C(OC6OCC(O)C(O)C6O)CCC56CC46C(O)CC3(C)C12 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Cimicifuga foetida | Subterraneous stems | 0.000767% | Phytochemistry 42(2): 489-494. | 10.1016/0031-9422(95)00895-0 |
Properties
| HBA | 9 | HBD | 6 |
| HeavyAtoms | 41 | AlogP | 1.45 |
| TPSA | 156.91 | RotatableBonds | 2 |
| FractionCSP3 | 0.91 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |