input word = C00050825

Metabolite InformationStructural formula
Name Inflacoumarin A
Formula C20H18O4
Mw 322.12050906
CAS RN 158446-33-4
C_ID C00050825
InChIKey RNBLSJGPSGNSIN-UHFFFAOYSA-N
InChICode InChI=1S/C20H18O4/c1-12(2)3-4-14-9-17-16(13-5-7-15(21)8-6-13)10-20(23)24-19(17)11-18(14)22/h3,5-11,21-22H,4H2,1-2H3
SMILES CC(C)=CCc1cc2c(-c3ccc(O)cc3)cc(=O)oc2cc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza glabra Ref.
PlantaeFabaceaeGlycyrrhiza inflata Ref.
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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