TPCN01804
![[object Object]](../../static/browser_molecular_png/TPCN01804.png)
| Name | Shizukaol B |
| Molecular Formula | C40H44O13 |
| Molecular Weight | 732.78 |
| CAS Registry Number | 142279-40-1 |
| SMILES | COC(=O)C(C)=C1C(=O)C(O)C2(C)C3=C(CC4C5(OC(=O)C6=C5CC5C(O)(COC(=O)C(C)=CCOC(=O)CCC(=O)OC6)C6CC6C54C)C13)C1CC12 |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Chloranthaceae | Chloranthus serratus | Roots | 0.000104% | J Nat Prod 82, 407-411.（2019） | 10.1021/acs.jnatprod.8b00418 |
Properties
| HBA | 13 | HBD | 2 |
| HeavyAtoms | 53 | AlogP | 2.38 |
| TPSA | 189.03 | RotatableBonds | 1 |
| FractionCSP3 | 0.65 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |