| Compound Information | |
|---|---|
| ID | 309 |
| TrivialName | Quinquenoside L9 |
| Type | C17-side chain varied |
| MF | C₄₂H₇₄O₁₅ |
| MolecularWeight | 819.039000000001 |
| IUPACName | NT |
| m/z | 863.4991 |
| Retention Time | 16.17 |
| CCS | 300.16 |
| Adducts | [M−H+HCOOH]− |
| Isomeric SMILES | O[C@@H]1[C@@H](O[C@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O2)[C@H](O[C@@H]3C4C(C)(C)[C@@H](O)CC[C@]4(C)C5[C@@]([C@@](CCC6[C@](O)(C)CCC(O)C(O)(C)C)(C)C6[C@H](O)C5)(C)C3)O[C@H](CO)[C@H]1O |
| Canonical SMILES | CC1OC(OC2C(OC3CC4(C)C(CC(O)C5C(C(C)(O)CCC(O)C(C)(C)O)CCC54C)C4(C)CCC(O)C(C)(C)C34)OC(CO)C(O)C2O)C(O)C(O)C1O |
| Source | PQ |
| Functions | anti-inflammatory |
| Year | 2001 |
| References | |
| Structure |
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