| Compound Information | |
|---|---|
| ID | 607 |
| TrivialName | Chikusetsusaponin LN4 |
| Type | PPD |
| MF | C₅₂H₈₆O₂₁ |
| MolecularWeight | 1047.239 |
| 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](O)[C@H](O)CO3)[C@@H](O)[C@H](O)[C@@H](CO)O2)CC[C@@]4(C)C1CC[C@]([C@@]5(C)C6C([C@](O[C@H]7[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]8[C@H](O)[C@@H](O)[C@@H](O)CO8)O7)(C)CC/C=C(C)/C)CC5)(C)C4CC6=O |
| Canonical SMILES | CC(C)=CCCC(C)(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(=O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OCC(O)C(O)C4O)C(C)(C)C3CCC12C |
| Source | PJ |
| Functions | NT |
| Year | 2012 |
| References | |
| Structure |
|