GinDB-AI: An integrated ginsenoside database and AI-driven platform for multidimensional information and biological activity prediction
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Compound Information
ID 390
TrivialName quinquefoloside Le
Type C17-side chain varied
MF C₄₈H₈₀O₁₈
MolecularWeight 945.150000000001
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)[C@@H](CO)O3)[C@@H](O)[C@H](O)[C@@H](CO)O2)CC[C@@]4(C)C1C([H])C[C@]5(C)C4C[C@@H]6C7[C@@]5(C)CCC7[C@@](C)(O[C@H]8[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O8)CC(/C=C(C)/C)O6
Canonical SMILES CC(C)=CC1CC(C)(OC2OC(CO)C(O)C(O)C2O)C2CCC3(C)C2C(CC2C4(C)CCC(OC5OC(CO)C(O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC23C)O1
Source PQ
Functions NT
Year 2013
References

Xiang et al. (2013)

Structure quinquefoloside Le