TPCN00849
![[object Object]](../../static/browser_molecular_png/TPCN00849.png)
| Name | 8a-Tigloyloxyhirsutinolide 13-O-acetate;8a-tigloyloxy-hirsutinolide-13-O-acetate |
| Molecular Formula | C22H28O8 |
| Molecular Weight | 420.46 |
| CAS Registry Number | 83182-58-5 |
| SMILES | CC=C(C)C(=O)OC1CC(C)C2(O)CCC(C)(C=C3OC(=O)C(COC(C)=O)=C31)O2 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Vernonia cinerea | Whole plants | 0.035000% | Chem Pharm Bull (Tokyo) 54(10): 1437-1439.(2006) | 10.1248/cpb.54.1437 |
| Asteraceae | Vernonia chinensis | Whole plants | 0.002640% | Planta Med 71(10): 949-954.（2005） | 10.1055/s-2005-871212 |
Properties
| HBA | 8 | HBD | 1 |
| HeavyAtoms | 30 | AlogP | 2.46 |
| TPSA | 108.36 | RotatableBonds | 4 |
| FractionCSP3 | 0.59 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |