TPCN03251
![[object Object]](../../static/browser_molecular_png/TPCN03251.png)
| Name | 2-O-(2-O-Isovaleryl-??-D-glucopyranosyl)atractyligenin |
| Molecular Formula | C30H46O10 |
| Molecular Weight | 566.69 |
| CAS Registry Number | 68711-84-2 |
| SMILES | C=C1C2CCC3C4(C)CC(OC5OC(CO)C(O)C(O)C5OC(=O)CC(C)C)CC(C(=O)O)C4CCC3(C2)C1O |
| Classify | Diterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Xanthium chinense | Fruits | 0.000009% | J Asian Nat Prod Res 21, 207-216 (2019). | 10.1080/10286020.2018.1526788 |
Properties
| HBA | 10 | HBD | 5 |
| HeavyAtoms | 40 | AlogP | 2.01 |
| TPSA | 162.98 | RotatableBonds | 7 |
| FractionCSP3 | 0.87 | Rings | 5 |
| AromaticRings | 0 | AliphaticRings | 5 |