TPCN04756
![[object Object]](../../static/browser_molecular_png/TPCN04756.png)
| Name | Clethroidoside H |
| Molecular Formula | C42H68O14 |
| Molecular Weight | 796.99 |
| CAS Registry Number | 1335200-71-9 |
| SMILES | CC1C(COC2OC(CO)C(O)C(O)C2O)C(OC2OC(CO)C(O)C(O)C2O)CC2(C)CCC3(C)C(=CC=C4C5(C)CC(O)C(O)C(C)(C)C5CCC43C)C12 |
| 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 | 14 | HBD | 10 |
| HeavyAtoms | 56 | AlogP | 0.51 |
| TPSA | 239.22 | RotatableBonds | 7 |
| FractionCSP3 | 0.90 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |