TPCN03194
![[object Object]](../../static/browser_molecular_png/TPCN03194.png)
| Name | Vitepyrroloid A |
| Molecular Formula | C21H32N2O |
| Molecular Weight | 328.50 |
| CAS Registry Number | 2097488-16-7 |
| SMILES | CC1CCC2C(C)(C)CCCC2(C)C1(O)CCc1cc[nH]c1C#N |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Verbenaceae | Vitex trifolia | Leaves | 0.000028% | J Nat Prod 80, 1679-1683 (2017). | 10.1021/acs.jnatprod.6b01195 |
Properties
| HBA | 3 | HBD | 2 |
| HeavyAtoms | 24 | AlogP | 4.81 |
| TPSA | 59.81 | RotatableBonds | 3 |
| FractionCSP3 | 0.76 | Rings | 3 |
| AromaticRings | 1 | AliphaticRings | 2 |