TPCN03205
![[object Object]](../../static/browser_molecular_png/TPCN03205.png)
| Name | Aconicarmisulfonine A |
| Molecular Formula | C22H29NO6S |
| Molecular Weight | 435.54 |
| CAS Registry Number | 2220998-28-5 |
| SMILES | CCN1CC2(C)CCC(O)C34C1C(CC23)C12C=C(S(=O)(=O)O)C(=O)C(C1)C(=O)CC24 |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Aconitum carmichaelii | Roots | 0.000024% | Org Lett 20, 816-819 (2018). | 10.1021/acs.orglett.7b03956 |
Properties
| HBA | 7 | HBD | 2 |
| HeavyAtoms | 30 | AlogP | 1.42 |
| TPSA | 111.98 | RotatableBonds | 2 |
| FractionCSP3 | 0.82 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |