TPCN05377
![[object Object]](../../static/browser_molecular_png/TPCN05377.png)
| Name | 3-epibartogenic acid |
| Molecular Formula | C30H46O7 |
| Molecular Weight | 518.69 |
| CAS Registry Number | 1801585-52-3 |
| SMILES | CC1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C(=O)O)C5CCC43C)C2C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Pedaliaceae | Sesamum indicum | Leaves | 0.002050% | Nat Prod Res. 2016. 30, 311-315. | 10.1080/14786419.2015.1057730 |
Properties
| HBA | 7 | HBD | 5 |
| HeavyAtoms | 37 | AlogP | 4.24 |
| TPSA | 135.29 | RotatableBonds | 2 |
| FractionCSP3 | 0.87 | Rings | 5 |
| AromaticRings | 0 | AliphaticRings | 5 |