TPCN00336
![[object Object]](../../static/browser_molecular_png/TPCN00336.png)
| Name | Scholarisins ?? |
| Molecular Formula | C22H26N2O4 |
| Molecular Weight | 382.46 |
| CAS Registry Number | 1609211-39-3 |
| SMILES | CC=C1CN2C(OC)CC34C(=Nc5ccccc53)C2CC1C4(CO)C(=O)OC |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apocynaceae | Alstonia scholaris | Leaves | 0.000493% | Molecules, 2013, 18, 7309-7322. | 10.3390/molecules18067309 |
Properties
| HBA | 6 | HBD | 1 |
| HeavyAtoms | 28 | AlogP | 2.19 |
| TPSA | 71.36 | RotatableBonds | 3 |
| FractionCSP3 | 0.55 | Rings | 5 |
| AromaticRings | 1 | AliphaticRings | 4 |