TPCN06133
![[object Object]](../../static/browser_molecular_png/TPCN06133.png)
| Name | Dianthosaponin H |
| Molecular Formula | C48H76O21 |
| Molecular Weight | 989.12 |
| CAS Registry Number | 2185902-11-6 |
| SMILES | CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(O)C(C)(C(=O)O)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Dianthus japonicus | Aerial parts | 0.000625% | J Nat Med . 2016 Oct;70(4):816-24 | 10.1007/s11418-016-1019-8 |
Properties
| HBA | 21 | HBD | 13 |
| HeavyAtoms | 69 | AlogP | -1.82 |
| TPSA | 352.51 | RotatableBonds | 10 |
| FractionCSP3 | 0.92 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |