TPCN04678
![[object Object]](../../static/browser_molecular_png/TPCN04678.png)
| Name | Chikusetsusaponin V Ethyl Ester |
| Molecular Formula | C50H80O19 |
| Molecular Weight | 985.17 |
| CAS Registry Number | 2079892-87-6 |
| SMILES | CCOC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)OC5OC(CO)C(O)C(O)C5O)CCC34C)C2(C)C)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Araliaceae | Panax japonicus | Roots | 0.000119% | J Nat Prod 79(12): 3079-3085. | 10.1021/acs.jnatprod.6b00748 |
Properties
| HBA | 19 | HBD | 10 |
| HeavyAtoms | 69 | AlogP | 0.71 |
| TPSA | 301.05 | RotatableBonds | 10 |
| FractionCSP3 | 0.92 | Rings | 8 |
| AromaticRings | 0 | AliphaticRings | 8 |