TPCN01745
![[object Object]](../../static/browser_molecular_png/TPCN01745.png)
| Name | Neobritannilactone A |
| Molecular Formula | C17H26O5 |
| Molecular Weight | 310.39 |
| CAS Registry Number | 886989-99-7 |
| SMILES | CC(=O)OCCCC(C)C1=CC2C(CC1(C)O)OC(=O)C2C |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Inula britannica | Flowers | 0.000150% | J Nat Prod 69, 531-535.(2006) | 10.1021/np050437q |
Properties
| HBA | 5 | HBD | 1 |
| HeavyAtoms | 22 | AlogP | 2.22 |
| TPSA | 72.83 | RotatableBonds | 5 |
| FractionCSP3 | 0.76 | Rings | 2 |
| AromaticRings | 0 | AliphaticRings | 2 |