input word = C00015537

Metabolite InformationStructural formula
Name 3,4,5-Trimethoxy-3',4'-dithoxybibenzyl 3'-O-glucoside
Icariside A4
Formula C22H28O10
Mw 452.16824712
CAS RN 117596-82-4
C_ID C00015537 ,
InChIKey DDEQISZAMYYNGL-MPJOEVFLNA-N
InChICode InChI=1S/C22H28O10/c1-29-16-9-12(7-14(25)21(16)30-2)4-3-11-5-6-13(24)15(8-11)31-22-20(28)19(27)18(26)17(10-23)32-22/h5-9,17-20,22-28H,3-4,10H2,1-2H3/t17-,18+,19-,20-,22+/m0/s1
SMILES c1c(c(cc(c1)CCc1cc(c(c(c1)OC)OC)O)O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBerberidaceaeEpimedium grandiflorum var. thunbergianum Ref.
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