input word = C00013336

Metabolite InformationStructural formula
Name Leucanthogenin
5,8,3',4'-Tetrahydroxy-6,7-dimethoxyflavone
2-(3,4-Dihydroxyphenyl)-5,8-dihydroxy-6,7-dimethoxy-4H-1-benzopyran-4-one
Formula C17H14O8
Mw 346.06886743
CAS RN 99615-00-6
C_ID C00013336 ,
InChIKey VZNIMRVJHRTTKA-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O8/c1-23-16-13(21)12-10(20)6-11(7-3-4-8(18)9(19)5-7)25-15(12)14(22)17(16)24-2/h3-6,18-19,21-22H,1-2H3
SMILES c12c(c(c(c(c1O)OC)OC)O)oc(cc2=O)c1cc(c(cc1)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeNepeta cataria Ref.
PlantaeLabiataeNepeta spp. Ref.
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OrganismNepeta spp.
ReferenceTomas-Barberan,Biochem.Syst.Ecol.,19,(1991),697