TPCN00461
![[object Object]](../../static/browser_molecular_png/TPCN00461.png)
| Name | 12-hydroxyakuamicine |
| Molecular Formula | C20H22N2O3 |
| Molecular Weight | 338.41 |
| CAS Registry Number | 1963-86-6 |
| SMILES | CC=C1CN2CCC34C(=C(C(=O)OC)C1CC23)Nc1c(O)cccc14 |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apocynaceae | Tabernaemontana pandacaqui | Aerial parts | 0.000250% | Chem Biodivers, 2018, 15, e1800268. | 10.1002/cbdv.201800268 |
Properties
| HBA | 5 | HBD | 2 |
| HeavyAtoms | 25 | AlogP | 2.54 |
| TPSA | 61.80 | RotatableBonds | 1 |
| FractionCSP3 | 0.45 | Rings | 5 |
| AromaticRings | 1 | AliphaticRings | 4 |