input word = C00014314

Metabolite InformationStructural formula
Name Licorice glycoside C2
(2S)-7,4'-Dihydroxyflavanone 4'-[4-feruloylapiosyl-(1->2)-glucoside]
Formula C36H38O16
Mw 726.21598517
CAS RN 202657-55-4
C_ID C00014314 ,
InChIKey GSIREHLZHMQJNR-RNKIWNGUNA-N
InChICode InChI=1S/C36H38O16/c1-46-27-12-18(2-10-23(27)39)3-11-29(41)47-16-36(45)17-48-35(33(36)44)52-32-31(43)30(42)28(15-37)51-34(32)49-21-7-4-19(5-8-21)25-14-24(40)22-9-6-20(38)13-26(22)50-25/h2-13,25,28,30-35,37-39,42-45H,14-17H2,1H3/b11-3+/t25-,28-,30+,31-,32-,33+,34+,35-,36+/m0/s1
SMILES COc1cc(/C=C/C(=O)OCC2(O)CO[C@@H](OC3[C@H](Oc4ccc([C@@H]5CC(=O)c6ccc(O)cc6O5)cc4)OC(CO)[C@@H](O)[C@@H]3O)[C@H]2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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