TPCN04238
![[object Object]](../../static/browser_molecular_png/TPCN04238.png)
| Name | Herniariasaponin D |
| Molecular Formula | C60H94O29 |
| Molecular Weight | 1279.38 |
| CAS Registry Number | 184477-12-1 |
| SMILES | CC1OC(OC2C(OC3C(O)CC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)OC6OC(C)C(O)C(OC7OC(C)C(O)C(O)C7O)C6OC6OC(C)C(O)C(O)C6O)C(O)CC45C)C3(C)C(=O)O)OC(C(=O)O)C(O)C2O)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Herniaria fontanesii | Aerial parts | 0.004400% | Phytochemistry 43(5): 1075-1077. | 10.1016/s0031-9422(96)00398-6 |
Properties
| HBA | 29 | HBD | 16 |
| HeavyAtoms | 89 | AlogP | -3.00 |
| TPSA | 467.19 | RotatableBonds | 12 |
| FractionCSP3 | 0.92 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |