TPCN02940
![[object Object]](../../static/browser_molecular_png/TPCN02940.png)
| Name | Isoatisine |
| Molecular Formula | C22H33NO2 |
| Molecular Weight | 343.51 |
| CAS Registry Number | 510-38-3 |
| SMILES | C=C1C2CCC3(CCC4C5(C)CCCC4(CN4CCOC45)C3C2)C1O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Aconitum richardsonianum | Roots | 0.000155% | J Pharm Anal 1, 57-59 (2011). | 10.1016/S2095-1779(11)70010-7 |
| Ranunculaceae | Delphinium honanense | Whole plants | 0.000085% | Chem Biodivers 8, 2104-2109 (2011). | 10.1002/cbdv.201000243 |
Properties
| HBA | 3 | HBD | 1 |
| HeavyAtoms | 25 | AlogP | 3.58 |
| TPSA | 32.70 | RotatableBonds | 0 |
| FractionCSP3 | 0.91 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |