| Compound Information | |
|---|---|
| ID | 442 |
| TrivialName | notoginsenoside NL-J |
| Type | C17-side chain varied |
| MF | C₅₇H₉₄O₂₇ |
| MolecularWeight | 1211.352 |
| IUPACName | NT |
| m/z | NT |
| Retention Time | NT |
| CCS | NT |
| Adducts | NT |
| Isomeric SMILES | CC1(C)[C@@H](O[C@H]2[C@H](O[C@H]3[C@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)CO4)[C@@H](O)[C@H](O)[C@@H](CO)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)CC[C@@]5(C)C1CC[C@]6(C)C5C[C@@H]7C8[C@@]6(C)CCC8[C@@](C)(O[C@H]9[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]%10[C@H](O)[C@@H](O)[C@H](O)CO%10)O9)C[C@H](CC(C)=O)O7 |
| Canonical SMILES | CC(=O)CC1CC(C)(OC2OC(COC3OCC(O)C(O)C3O)C(O)C(O)C2O)C2CCC3(C)C2C(CC2C4(C)CCC(OC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5OC5OCC(O)C(O)C5O)C(C)(C)C4CCC23C)O1 |
| Source | PN |
| Functions | anti-inflammatory |
| Year | 2020 |
| References | |
| Structure |
|