GinDB-AI: An integrated ginsenoside database and AI-driven platform for multidimensional information and biological activity prediction
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Compound Information
ID 696
TrivialName Notoginsenic acid β-sophoroside
Type Miscellaneous
MF C₂₂H₃₂O₁₃
MolecularWeight 504.485
IUPACName NT
m/z NT
Retention Time NT
CCS NT
Adducts NT
Isomeric SMILES O[C@@H]1[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)[C@H](OCCCC#CC#CCCC(O)=O)O[C@H](CO)[C@H]1O
Canonical SMILES O=C(O)CCC#CC#CCCCOC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O
Source PN
Functions NT
Year 2004
References

Jin-huai et al. (2004)

Structure Notoginsenic acid β-sophoroside