input word = C00014312

Metabolite InformationStructural formula
Name Licorice glycoside D2
(2S)-7,4'-Dihydroxyflavanone 4'-[4-p-coumaroylapiosyl-(1->2)-glucoside]
Formula C35H36O15
Mw 696.20542048
CAS RN 202657-65-6
C_ID C00014312 ,
InChIKey KDXWZGOCBQGWEB-MIXHJEJPNA-N
InChICode InChI=1S/C35H36O15/c36-15-27-29(41)30(42)31(50-34-32(43)35(44,17-46-34)16-45-28(40)12-3-18-1-6-20(37)7-2-18)33(49-27)47-22-9-4-19(5-10-22)25-14-24(39)23-11-8-21(38)13-26(23)48-25/h1-13,25,27,29-34,36-38,41-44H,14-17H2/b12-3+/t25-,27+,29+,30-,31+,32+,33+,34-,35+/m0/s1
SMILES O=C(/C=C/c1ccc(O)cc1)OCC1(O)CO[C@@H](OC2[C@H](Oc3ccc([C@@H]4CC(=O)c5ccc(O)cc5O4)cc3)OC(CO)[C@@H](O)[C@@H]2O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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OrganismGlycyrrhiza uralensis
ReferenceHatano,Phytochem.,47,(1998),287