input word = C00021326

Metabolite InformationStructural formula
Name Triflorestevione
Formula C25H36O6
Mw 432.25118888
CAS RN 115794-33-7
C_ID C00021326 ,
InChIKey GWIHCVOQQVSWBT-CURFMVGPNA-N
InChICode InChI=1S/C25H36O6/c1-9-12(3)22(28)30-19-20(27)25(8)16-14(5)11-15(26)17(25)18(16)24(6,7)21(19)31-23(29)13(4)10-2/h9-10,14,16-21,27H,11H2,1-8H3/b12-9+,13-10+/t14-,16+,17-,18+,19+,20-,21-,25-/m1/s1
SMILES C/C=C(C)C(=O)O[C@@H]1[C@@H](OC(=O)/C(C)=C/C)C(C)(C)[C@H]2C3[C@H](C)CC(=O)[C@H]2[C@]3(C)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeStevia triflora Ref.
zoom in