TPCN03202
![[object Object]](../../static/browser_molecular_png/TPCN03202.png)
| Name | Vitepyrroloid B |
| Molecular Formula | C27H42N2O3 |
| Molecular Weight | 442.64 |
| CAS Registry Number | 2097488-17-8 |
| SMILES | CCOC(=O)CCCn1ccc(CCC2(O)C(C)CCC3C(C)(C)CCCC32C)c1C#N |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Verbenaceae | Vitex trifolia | Leaves | 0.000025% | J Nat Prod 80, 1679-1683 (2017). | 10.1021/acs.jnatprod.6b01195 |
Properties
| HBA | 5 | HBD | 1 |
| HeavyAtoms | 32 | AlogP | 5.63 |
| TPSA | 75.25 | RotatableBonds | 8 |
| FractionCSP3 | 0.78 | Rings | 3 |
| AromaticRings | 1 | AliphaticRings | 2 |