TPCN01465
![[object Object]](../../static/browser_molecular_png/TPCN01465.png)
| Name | Orbiculin F |
| Molecular Formula | C34H36O11 |
| Molecular Weight | 620.65 |
| CAS Registry Number | 227450-70-6 |
| SMILES | CC(=O)OC1C(OC(=O)c2ccoc2)CC(C)C23OC(C)(C)C(CC(OC(=O)c4ccccc4)C12C)C3OC(=O)c1ccoc1 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Celastrus orbiculatus | Roots | 0.000425% | J Nat Prod 62(5): 697-700.(1999) | 10.1021/np9804379 |
Properties
| HBA | 11 | HBD | 0 |
| HeavyAtoms | 45 | AlogP | 5.39 |
| TPSA | 140.71 | RotatableBonds | 7 |
| FractionCSP3 | 0.47 | Rings | 6 |
| AromaticRings | 3 | AliphaticRings | 3 |