TPCN02647
![[object Object]](../../static/browser_molecular_png/TPCN02647.png)
| Name | 13??-Acetoxy-15??,19??-dihydroxyhetisane |
| Molecular Formula | C22H29NO4 |
| Molecular Weight | 371.48 |
| CAS Registry Number | 2357208-82-1 |
| SMILES | C=C1C2CC3C4(CC5C6C7(C)CCCC63C(C4C2OC(C)=O)N5C7O)C1O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Aconitum carmichaelii | Roots | 0.000460% | J Nat Prod 82, 980-989 (2019). | 10.1021/acs.jnatprod.8b01039 |
Properties
| HBA | 5 | HBD | 2 |
| HeavyAtoms | 27 | AlogP | 1.68 |
| TPSA | 70.00 | RotatableBonds | 1 |
| FractionCSP3 | 0.86 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |