Compound Information | |
---|---|
ID | 22 |
TrivialName | Ginsenoside Ra8 |
Type | PPD |
MF | C₅₇H₉₄O₂₃ |
MolecularWeight | 1147.356 |
IUPACName | NT |
m/z | 1191.6165 |
Retention Time | 46.14 |
CCS | 365.54 |
Adducts | [M−H+HCOOH]− |
Isomeric SMILES | CC1(C)[C@@H](O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](OC(/C([H])=C([H])/C)=O)[C@@H](CO)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)CC[C@@]4(C)C1CC[C@]5(C)C4C[C@@H](O)C6[C@@]5(C)CCC6[C@@](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](CO)O8)O7)CC/C=C(C)/C |
Canonical SMILES | CC=CC(=O)OC1C(CO)OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC(O)C4C(C(C)(CCC=C(C)C)OC6OC(COC7OC(CO)C(O)C7O)C(O)C(O)C6O)CCC45C)C3(C)C)OC(CO)C(O)C2O)C(O)C1O |
Source | PG |
Functions | NT |
Year | 2011 |
References | |
Structure |
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