TPCN02479
![[object Object]](../../static/browser_molecular_png/TPCN02479.png)
| Name | (4R,4aR,6aS,7R,9S,10aS,10bS)-Octahydro-7-hydroxy-4-methyl-8-methylene-1H,7H-6a,9-ethano-4,10b-propanobenz[h]isoquinoline-2(3H)-acetaldehyde |
| Molecular Formula | C22H33NO2 |
| Molecular Weight | 343.51 |
| CAS Registry Number | 149998-46-9 |
| SMILES | C=C1C2CCC3(CCC4C5(C)CCCC4(CN(CC=O)C5)C3C2)C1O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Aconitum naviculare | Aerial parts | 0.001000% | Fitoterapia 120, 142-145 (2017). | 10.1016/j.fitote.2017.06.008 |
Properties
| HBA | 3 | HBD | 1 |
| HeavyAtoms | 25 | AlogP | 3.42 |
| TPSA | 40.54 | RotatableBonds | 2 |
| FractionCSP3 | 0.86 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |