| Compound Information | |
|---|---|
| ID | 319 |
| TrivialName | Yesanchinoside H |
| Type | C17-side chain varied |
| MF | C₅₃H₉₀O₂₃ |
| MolecularWeight | 1095.28 |
| IUPACName | NT |
| m/z | 1093.5771 |
| Retention Time | 38.77 |
| CCS | 348.86 |
| Adducts | [M−H+HCOOH]− |
| Isomeric SMILES | CC(O)(C)/C=C/C[C@](C)(O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)O1)C3CC[C@@]4(C)[C@]5(C)CC([H])C6C(C)(C)[C@@H](O[C@H]7[C@H](O[C@H]8[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O8)[C@@H](O)[C@H](O)[C@@H](CO)O7)CC[C@]6(C)C5C[C@@H](O)C43 |
| Canonical SMILES | CC(C)(O)C=CCC(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)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC12C |
| Source | PJ |
| Functions | NT |
| Year | 2002 |
| References | |
| Structure |
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