input word = C00053030

Metabolite InformationStructural formula
Name Dehydroglyasperin C
Formula C21H22O5
Mw 354.14672381
CAS RN 199331-35-6
C_ID C00053030
InChIKey RCZMWVKBVFOCEE-UHFFFAOYSA-N
InChICode InChI=1S/C21H24O5/c1-12(2)4-6-16-19(24)10-20-17(21(16)25-3)8-13(11-26-20)15-7-5-14(22)9-18(15)23/h4-5,7,9-10,13,22-24H,6,8,11H2,1-3H3
SMILES COc1c(CC=C(C)C)c(O)cc2c1CC(c1ccc(O)cc1O)CO2
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.