TPCN03886
![[object Object]](../../static/browser_molecular_png/TPCN03886.png)
| Name | Clemastanoside D |
| Molecular Formula | C52H84O21 |
| Molecular Weight | 1045.22 |
| CAS Registry Number | 172671-38-4 |
| SMILES | CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)OC6OC(CO)C(O)C(O)C6O)CCC45C)C3(C)CO)OCC(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Ranunculaceae | Clematis uncinata | Roots | 0.001200% | Chem Pharm Bull (Tokyo) 62(1): 35-44. | 10.1248/cpb.c13-00269 |
| Verbenaceae | Clerodendrum philippinum | Whole plants | 0.000400% | Nat Prod Res 29, 1228-1234 (2015). | 10.1080/14786419.2015.1023725 |
Properties
| HBA | 21 | HBD | 12 |
| HeavyAtoms | 73 | AlogP | -0.76 |
| TPSA | 333.67 | RotatableBonds | 10 |
| FractionCSP3 | 0.94 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |