TPCN04939
![[object Object]](../../static/browser_molecular_png/TPCN04939.png)
| Name | Mirabilin lactone |
| Molecular Formula | C58H92O27 |
| Molecular Weight | 1221.35 |
| CAS Registry Number | 186540-12-5 |
| SMILES | CC12CCC3(COC1=O)C(O)CC1(C)C(=CCC4C5(C)CCC(OC6OCC(OC7OC(COC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7OC7OCC(O)C(O)C7O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC41C)C3C2 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Primulaceae | Cyclamen coum | Subterraneous stems | 0.005000% | Planta Med 63, 166-170 (1997) | 10.1055/s-2006-957637 |
Properties
| HBA | 27 | HBD | 15 |
| HeavyAtoms | 85 | AlogP | -3.94 |
| TPSA | 422.05 | RotatableBonds | 13 |
| FractionCSP3 | 0.95 | Rings | 12 |
| AromaticRings | 0 | AliphaticRings | 12 |