TPCN01907
![[object Object]](../../static/browser_molecular_png/TPCN01907.png)
| Name | Elescabertopin B |
| Molecular Formula | C32H32O10 |
| Molecular Weight | 576.60 |
| CAS Registry Number | 2095768-65-1 |
| SMILES | C=C1C(=O)OC2C=C(C)CC3C=C(CC(OC(=O)C4(C)CCC(C)(O)c5oc6cc(O)cc-6c(C(C)=O)c54)C12)C(=O)O3 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Elephantopus scaber | Whole plants | 0.000055% | Magn Reson Chem 55(7): 677-681.(2017) | 10.1002/mrc.4567 |
Properties
| HBA | 10 | HBD | 2 |
| HeavyAtoms | 42 | AlogP | 4.15 |
| TPSA | 149.57 | RotatableBonds | 3 |
| FractionCSP3 | 0.44 | Rings | 6 |
| AromaticRings | 0 | AliphaticRings | 6 |