TPCN03203
![[object Object]](../../static/browser_molecular_png/TPCN03203.png)
| Name | Semiaquilegoside A |
| Molecular Formula | C26H38O9 |
| Molecular Weight | 494.58 |
| CAS Registry Number | 904921-95-5 |
| SMILES | CC(C)c1cc2c(c(O)c1OC1OC(CO)C(O)C(O)C1O)C1(C)CCC(O)C(C)(C)C1C(=O)C2 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Semiaquilegia adoxoides | Roots | 0.000025% | Magn Reson Chem 44, 724-726 (2006). | 10.1002/mrc.1812 |
Properties
| HBA | 9 | HBD | 6 |
| HeavyAtoms | 35 | AlogP | 0.87 |
| TPSA | 156.91 | RotatableBonds | 4 |
| FractionCSP3 | 0.73 | Rings | 4 |
| AromaticRings | 1 | AliphaticRings | 3 |