input word = C00014495

Metabolite InformationStructural formula
Name Isoliquiritigenin 4'-O-glucoside 4-O-apiofuranosyl-(1'''->2''')-glucoside
4,2',4'-Trihydroxychalcone 4'-O-glucoside 4-O-apiofuranosyl-(1'''->2''')-glucoside
Formula C32H40O18
Mw 712.22146448
CAS RN 217483-71-1
C_ID C00014495 ,
InChIKey FYJCXNYYSACEJK-BQQUYKSCNA-N
InChICode InChI=1S/C32H40O18/c33-10-20-22(38)24(40)26(42)29(48-20)47-16-6-7-17(19(37)9-16)18(36)8-3-14-1-4-15(5-2-14)46-30-27(25(41)23(39)21(11-34)49-30)50-31-28(43)32(44,12-35)13-45-31/h1-9,20-31,33-35,37-44H,10-13H2/b8-3+/t20-,21+,22-,23-,24-,25-,26+,27+,28+,29+,30+,31-,32+/m0/s1
SMILES c1(cc(c(cc1)C(=O)/C=C/c1ccc(cc1)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O[C@H]1[C@H]([C@@](O)(CO)CO1)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza aspera Ref.
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