TPCN03196
![[object Object]](../../static/browser_molecular_png/TPCN03196.png)
| Name | Philadelphinone |
| Molecular Formula | C25H38O6 |
| Molecular Weight | 434.57 |
| CAS Registry Number | 640289-62-9 |
| SMILES | CC(C)=CC(=O)OCCC1(C)CCC2(O1)C1(C)OC1C(O)C1C(C)(C)CCC(=O)C12C |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Erigeron annuus | Aerial parts | 0.000028% | Chem Pharm Bull (Tokyo) 51, 545-549 (2003). | 10.1248/cpb.51.545 |
Properties
| HBA | 6 | HBD | 1 |
| HeavyAtoms | 31 | AlogP | 3.74 |
| TPSA | 85.36 | RotatableBonds | 4 |
| FractionCSP3 | 0.84 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |