TPCN01528
![[object Object]](../../static/browser_molecular_png/TPCN01528.png)
| Name | Isopaulitin |
| Molecular Formula | C15H16O5 |
| Molecular Weight | 276.29 |
| CAS Registry Number | 76930-30-8 |
| SMILES | C=C1C(=O)OC2C1CCC1(C)OC13C=CC(=O)OC23C |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Ambrosia artemisiifolia | Whole plants | 0.000350% | Planta Med 71(10): 938-943.(2005) | 10.1055/s-2005-873109 |
Properties
| HBA | 5 | HBD | 0 |
| HeavyAtoms | 20 | AlogP | 1.28 |
| TPSA | 65.13 | RotatableBonds | 0 |
| FractionCSP3 | 0.60 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |