TPCN01478
![[object Object]](../../static/browser_molecular_png/TPCN01478.png)
| Name | 3 beta-acetoxy-8-oxoeremophil-6(7),9(10)-dien-12-oic methyl ester |
| Molecular Formula | C18H24O5 |
| Molecular Weight | 320.39 |
| CAS Registry Number | 1198361-59-9 |
| SMILES | COC(=O)C(C)C1=CC2(C)C(=CC1=O)CCC(OC(C)=O)C2C |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ligularia hodgsonii | Whole plants | 0.000400% | Planta Med 75(6): 635-640.(2019) | 10.1055/s-0029-1185359 |
Properties
| HBA | 5 | HBD | 0 |
| HeavyAtoms | 23 | AlogP | 2.60 |
| TPSA | 69.67 | RotatableBonds | 3 |
| FractionCSP3 | 0.61 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |