input word = C00053268

Metabolite InformationStructural formula
Name Glyurallin B
Formula C25H26O6
Mw 422.17293856
CAS RN 199331-53-8
C_ID C00053268
InChIKey DPLWUTYEBRKBLI-UHFFFAOYSA-N
InChICode InChI=1S/C25H26O6/c1-13(2)5-7-15-9-16(10-21(28)23(15)29)18-12-31-25-17(8-6-14(3)4)19(26)11-20(27)22(25)24(18)30/h5-6,9-12,26-29H,7-8H2,1-4H3
SMILES CC(C)=CCc1cc(-c2coc3c(CC=C(C)C)c(O)cc(O)c3c2=O)cc(O)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza glabra Ref.
PlantaeFabaceaeGlycyrrhiza inflata Ref.
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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OrganismGlycyrrhiza inflata
ReferenceSong, W. et al., Anal. Chem., 89, (2017), 3146-3153.