TPCN01155
![[object Object]](../../static/browser_molecular_png/TPCN01155.png)
| Name | Macrocliniside A |
| Molecular Formula | C21H28O9 |
| Molecular Weight | 424.45 |
| CAS Registry Number | 94474-61-0 |
| SMILES | C=C1C(=O)OC2C1CC(O)C(=C)C1CC(OC3OC(CO)C(O)C(O)C3O)C(=C)C12 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Schisandraceae | Lactuca canadensis | Roots | 0.001719% | Phytochemistry 90: 90-94.(2013) | 10.1016/j.phytochem.2013.02.005 |
Properties
| HBA | 9 | HBD | 5 |
| HeavyAtoms | 30 | AlogP | -1.22 |
| TPSA | 145.91 | RotatableBonds | 3 |
| FractionCSP3 | 0.67 | Rings | 4 |
| AromaticRings | 0 | AliphaticRings | 4 |