TPCN00549
![[object Object]](../../static/browser_molecular_png/TPCN00549.png)
| Name | Nb-demethylalstogustine N-oxide |
| Molecular Formula | C20H24N2O4 |
| Molecular Weight | 356.42 |
| CAS Registry Number | 125205-50-7 |
| SMILES | COC(=O)C1=C2Nc3ccccc3C23CC[N+]2([O-])CC(C(C)O)C1CC32 |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apocynaceae | Alstonia rostrata | Barks | 0.000143% | Org Lett, 2012, 14, 3450-3453. | 10.1021/ol301400e |
Properties
| HBA | 6 | HBD | 2 |
| HeavyAtoms | 26 | AlogP | 1.89 |
| TPSA | 81.62 | RotatableBonds | 2 |
| FractionCSP3 | 0.55 | Rings | 5 |
| AromaticRings | 1 | AliphaticRings | 4 |