GinDB-AI: An integrated ginsenoside database and AI-driven platform for multidimensional information and biological activity prediction
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Compound Information
ID 651
TrivialName Hemsloside-Ma3
Type OA
MF C₅₃H₈₄O₂₃
MolecularWeight 1089.232
IUPACName NT
m/z NT
Retention Time NT
CCS NT
Adducts NT
Isomeric SMILES CC1(C)CC[C@]2(C(O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)=O)CC[C@@]4(C)[C@]5(C)CC[C@H]6C(C)(C)[C@@H](O[C@H]7[C@H](O[C@H]8[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O8)[C@@H](O[C@H]9[C@H](O)[C@@H](O)[C@@H](O)CO9)[C@H](O)[C@@H](C(O)=O)O7)CC[C@]6(C)[C@H]5CC=C4[C@@H]2C1
Canonical SMILES CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1
Source PJ
Functions NT
Year 1984
References

Nie et al. (1984)

Structure Hemsloside-Ma3