GinDB-AI: An integrated ginsenoside database and AI-driven platform for multidimensional information and biological activity prediction
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Compound Information
ID 254
TrivialName Vinaginsenoside R14
Type C17-side chain varied
MF C₄₁H₇₀O₁₅
MolecularWeight 802.996000000001
IUPACName 2-[2-[[17-[5-(1,2-dihydroxypropan-2-yl)-2-methyloxolan-2-yl]-3,12-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxyoxane-3,4,5-triol
m/z NT
Retention Time NT
CCS NT
Adducts NT
Isomeric SMILES O[C@H]1C2[C@](CCC2[C@]3(C)CCC(C(C)(O)CO)O3)(C)[C@]4(C)C[C@H](O[C@@H]5[C@@H](O[C@@H]6[C@@H](O)[C@H](O)[C@@H](O)CO6)[C@H](O)[C@@H](O)[C@H](CO)O5)C7C(C)(C)[C@@H](O)CC[C@]7(C)C4C1
Canonical SMILES CC(O)(CO)C1CCC(C)(C2CCC3(C)C2C(O)CC2C4(C)CCC(O)C(C)(C)C4C(OC4OC(CO)C(O)C(O)C4OC4OCC(O)C(O)C4O)CC23C)O1
Source PV
Functions NT
Year 1994
References

Duc et al. (1994b)

Structure Vinaginsenoside R14