TPCN04755
![[object Object]](../../static/browser_molecular_png/TPCN04755.png)
| Name | Clethroidoside D |
| Molecular Formula | C52H84O21 |
| Molecular Weight | 1045.22 |
| CAS Registry Number | 1335200-67-3 |
| SMILES | CC1(C)CCC23COC4(CCC5C6(C)CCC(OC7OCC(OC8OC(CO)C(O)C(O)C8OC8OCC(O)C(O)C8O)C(O)C7OC7OC(CO)C(O)C(O)C7O)C(C)(C)C6CCC5(C)C4(C)CC2=O)C3C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Primulaceae | Lysimachia clethroides | Aerial parts | 0.000050% | J Nat Prod 74(10): 2128-2136. | 10.1021/np2004038 |
Properties
| HBA | 21 | HBD | 11 |
| HeavyAtoms | 73 | AlogP | -0.86 |
| TPSA | 322.67 | RotatableBonds | 10 |
| FractionCSP3 | 0.98 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |