TPCN03223
![[object Object]](../../static/browser_molecular_png/TPCN03223.png)
| Name | Vitepyrroloid C |
| Molecular Formula | C27H40N2O5 |
| Molecular Weight | 472.63 |
| CAS Registry Number | 2097488-18-9 |
| SMILES | CC(=O)OC1CCC2(C)C(CCC(C)C2(O)CCc2ccn(CCCC(=O)O)c2C#N)C1(C)C |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Verbenaceae | Vitex trifolia | Leaves | 0.000017% | J Nat Prod 80, 1679-1683 (2017). | 10.1021/acs.jnatprod.6b01195 |
Properties
| HBA | 7 | HBD | 2 |
| HeavyAtoms | 34 | AlogP | 4.69 |
| TPSA | 112.55 | RotatableBonds | 8 |
| FractionCSP3 | 0.74 | Rings | 3 |
| AromaticRings | 1 | AliphaticRings | 2 |