TPCN00979
![[object Object]](../../static/browser_molecular_png/TPCN00979.png)
| Name | 1S,6R-di(2-)methylbutanoyloxy-4S-hydroxy-8S-benzoyloxy-9R-(3-)furancarbonyloxy-13 -acetyloxy-beta-dihydroagarofuran |
| Molecular Formula | C39H50O13 |
| Molecular Weight | 726.82 |
| CAS Registry Number | 886752-60-9 |
| SMILES | CCC(C)C(=O)OC1CCC(C)(O)C23OC(C)(C)C(C(OC(=O)c4ccccc4)C(OC(=O)c4ccoc4)C12COC(C)=O)C3OC(=O)C(C)CC |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Euonymus nanoides | Seeds | 0.005258% | Chem Pharm Bull (Tokyo) 54(2): 219-221.(2006) | 10.1248/cpb.54.219 |
Properties
| HBA | 13 | HBD | 1 |
| HeavyAtoms | 52 | AlogP | 5.22 |
| TPSA | 174.10 | RotatableBonds | 12 |
| FractionCSP3 | 0.62 | Rings | 5 |
| AromaticRings | 2 | AliphaticRings | 3 |