TPCN01950
![[object Object]](../../static/browser_molecular_png/TPCN01950.png)
| Name | 1??,2??-diacetoxy-6??-benzoyloxy-9??-cinnamoyloxy-??-dihydroagarofuran |
| Molecular Formula | C35H40O9 |
| Molecular Weight | 604.70 |
| CAS Registry Number | 162972-66-9 |
| SMILES | CC(=O)OC1CC(C)C23OC(C)(C)C(CC(OC(=O)C=Cc4ccccc4)C2(C)C1OC(C)=O)C3OC(=O)c1ccccc1 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Celastraceae | Celastrus orbiculatus | Fruits | 0.000040% | Chem Pharm Bull (Tokyo) 52(9): 1134-1136.(2004) | 10.1248/cpb.52.1134 |
Properties
| HBA | 9 | HBD | 0 |
| HeavyAtoms | 44 | AlogP | 5.31 |
| TPSA | 114.43 | RotatableBonds | 7 |
| FractionCSP3 | 0.49 | Rings | 5 |
| AromaticRings | 2 | AliphaticRings | 3 |