TPCN01681
![[object Object]](../../static/browser_molecular_png/TPCN01681.png)
| Name | (4S,5S,6R,10R)-8,9-seco-12-hydroxyeremophil-7(11)-en-14,6;12,8-diolid-9-al |
| Molecular Formula | C15H18O6 |
| Molecular Weight | 294.30 |
| CAS Registry Number | 1300025-87-9 |
| SMILES | CC1=C(C2OC(=O)C3CCCC(C=O)C32C)C(=O)OC1O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ligularia hodgsonii | Roots | 0.000200% | Phytochemistry 72(6): 514-517.(2011) | 10.1016/j.phytochem.2011.01.008 |
Properties
| HBA | 6 | HBD | 1 |
| HeavyAtoms | 21 | AlogP | 0.73 |
| TPSA | 89.90 | RotatableBonds | 2 |
| FractionCSP3 | 0.67 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |