GinDB-AI: An integrated ginsenoside database and AI-driven platform for multidimensional information and biological activity prediction
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Compound Information
ID 258
TrivialName Ginsenoside Rh16
Type C17-side chain varied
MF C₃₆H₆₀O₈
MolecularWeight 620.868
IUPACName NT
m/z 619.4224
Retention Time 64.22
CCS 292.57
Adducts [M−H]−
Isomeric SMILES C/C(C1CC[C@@]2(C)[C@]3(C)C[C@H](O[H])C4C(C)(C)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O5)CC[C@]4(C)C3C[C@@H](O)C21)=C/C/C=C(C)/C
Canonical SMILES CC(C)=CCC=C(C)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3C(O)CC12C
Source PG
Functions NT
Year 2012
References

Li et al. (2012b)

Structure Ginsenoside Rh16