input word = C00014310

Metabolite InformationStructural formula
Name Licorice glycoside E
Formula C35H35NO14
Mw 693.20575484
CAS RN 202657-66-7
C_ID C00014310 ,
InChIKey GNJDLKNJCWOSBO-MSKGVBPVNA-N
InChICode InChI=1S/C35H35NO14/c37-14-27-28(40)29(41)30(50-34-31(42)35(44,16-46-34)15-45-32(43)22-13-36-23-4-2-1-3-20(22)23)33(49-27)47-19-8-5-17(6-9-19)25-12-24(39)21-10-7-18(38)11-26(21)48-25/h1-11,13,25,27-31,33-34,36-38,40-42,44H,12,14-16H2/t25-,27+,28-,29-,30+,31+,33+,34-,35-/m0/s1
SMILES c1(cc2c(cc1)C(=O)C[C@H](O2)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)(COC(=O)c2c[nH]c3c2cccc3)CO1)O)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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