TPCN03231
![[object Object]](../../static/browser_molecular_png/TPCN03231.png)
| Name | 14??-Benzoyloxy-N-ethyl-15??-hydroxy-1??,8??,16??,18-tetramethoxyaconitane |
| Molecular Formula | C32H45NO7 |
| Molecular Weight | 555.71 |
| CAS Registry Number | 2357208-86-5 |
| SMILES | CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)C(O)C(OC)(C(CC23)C14)C5C6OC(=O)c1ccccc1 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Aconitum carmichaelii | Roots | 0.000013% | J Nat Prod 82, 980-989 (2019). | 10.1021/acs.jnatprod.8b01039 |
Properties
| HBA | 8 | HBD | 1 |
| HeavyAtoms | 40 | AlogP | 3.02 |
| TPSA | 86.69 | RotatableBonds | 8 |
| FractionCSP3 | 0.78 | Rings | 7 |
| AromaticRings | 1 | AliphaticRings | 6 |