input word = C00042467

Metabolite InformationStructural formula
Name Devenyoside A
(-)-Devenyoside A
Formula C20H26O10
Mw 426.15259705
CAS RN 871904-60-8
C_ID C00042467 ,
InChIKey NXXWVYSMCQDTBE-IEFGJQSONA-N
InChICode InChI=1S/C20H26O10/c1-20(2,30-19-17(27)16(26)15(25)12(8-21)28-19)13(23)7-10-11(22)5-3-9-4-6-14(24)29-18(9)10/h3-6,12-13,15-17,19,21-23,25-27H,7-8H2,1-2H3/t12-,13+,15-,16+,17-,19+/m1/s1
SMILES c1(ccc2c(c1C[C@H](O)C(C)(O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)oc(=O)cc2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeSeseli devenyense Simonkai Ref.
zoom in