GinDB-AI: An integrated ginsenoside database and AI-driven platform for multidimensional information and biological activity prediction
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Compound Information
ID 167
TrivialName Saponin IIb
Type PPT
MF C₃₆H₆₂O₉
MolecularWeight 638.883
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](O)[C@H](O)[C@@H](CO)O2)CC[C@@]3(C)C1[C@@H](O[H])C[C@]4(C)C3C[C@@H](O)C5[C@@]4(C)CCC5[C@@](C)(O[H])CC/C=C(C)/C
Canonical SMILES CC(C)=CCCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3C(O)CC12C
Source PG
Functions anti-cancer
Year 2012
References

Ma et al. (2012)

Structure Saponin IIb