input word = C00005117

Metabolite InformationStructural formula
Name Neouralenol
2-[3,4-Dihydroxy-2-(3-methyl-2-butenyl)phenyl]-3,6,7-trihydroxy-4H-1-benzopyran-4-one
Formula C20H18O7
Mw 370.10525293
CAS RN 139163-16-9
C_ID C00005117 ,
InChIKey NACBYUYHTLUWAI-UHFFFAOYSA-N
InChICode InChI=1S/C20H18O7/c1-9(2)3-4-10-11(5-6-13(21)17(10)24)20-19(26)18(25)12-7-14(22)15(23)8-16(12)27-20/h3,5-8,21-24,26H,4H2,1-2H3
SMILES c1(c(cc2c(c1)oc(c(c2=O)O)c1ccc(c(c1CC=C(C)C)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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