TPCN00056
![[object Object]](../../static/browser_molecular_png/TPCN00056.png)
| Name | Echitamine |
| Molecular Formula | C22H29N2O4+ |
| Molecular Weight | 385.48 |
| CAS Registry Number | 6871-44-9 |
| SMILES | CC=C1C[N+]2(C)CCC34c5ccccc5NC32C(O)CC1C4(CO)C(=O)OC |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apocynaceae | Alstonia scholaris | Barks | 0.018000% | Planta Med, 2009, 75, 1537-1541. | 10.1055/s-0029-1185900 |
Properties
| HBA | 6 | HBD | 3 |
| HeavyAtoms | 28 | AlogP | 1.39 |
| TPSA | 78.79 | RotatableBonds | 2 |
| FractionCSP3 | 0.59 | Rings | 6 |
| AromaticRings | 1 | AliphaticRings | 5 |