input word = C00019496

Metabolite InformationStructural formula
Name Irisjaponin A
5,7-Dihydroxy-6,2',3',4',5'-pentamethoxyisoflavone
Formula C20H20O9
Mw 404.11073224
CAS RN 174423-26-8
C_ID C00019496 ,
InChIKey OITYQALEAYIBHE-UHFFFAOYSA-N
InChICode InChI=1S/C20H20O9/c1-24-13-6-9(17(25-2)20(28-5)19(13)27-4)10-8-29-12-7-11(21)18(26-3)16(23)14(12)15(10)22/h6-8,21,23H,1-5H3
SMILES COc1cc(-c2coc3cc(O)c(OC)c(O)c3c2=O)c(OC)c(OC)c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeIris japonica Ref.
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OrganismIris japonica
ReferenceMinami,Phytochem.,41,(1996),1219