TPCN04494
![[object Object]](../../static/browser_molecular_png/TPCN04494.png)
| Name | Breynceanothanolic Acid |
| Molecular Formula | C29H40O5 |
| Molecular Weight | 468.63 |
| CAS Registry Number | 1289417-58-8 |
| SMILES | C=C(C)C1CCC2(C(=O)O)CCC34C(=O)OC5(CCC3C12)C4(C)CCC12OC15C(C)CC2(C)C |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Euphorbiaceae | Breynia fruticosa | Roots | 0.000447% | J Nat Prod 74(5): 1161-1168. | 10.1021/np2000914 |
Properties
| HBA | 5 | HBD | 1 |
| HeavyAtoms | 34 | AlogP | 5.52 |
| TPSA | 76.13 | RotatableBonds | 2 |
| FractionCSP3 | 0.86 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |