input word = C00033051

Metabolite InformationStructural formula
Name Irisoid A
Formula C17H12O7
Mw 328.05830274
CAS RN 377724-74-8
C_ID C00033051 ,
InChIKey BJGPJGLFIWNAAZ-UHFFFAOYSA-N
InChICode InChI=1S/C17H12O7/c1-22-15-9(19)5-10-12(13(15)20)14(21)17-16(24-10)11-7(6-23-17)3-2-4-8(11)18/h2-5,18-20H,6H2,1H3
SMILES COc1c(O)cc2oc3c(c(=O)c2c1O)OCc1cccc(O)c1-3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeIris bungei Ref.
PlantaeIridaceaeIris tenuifolia Ref.
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OrganismIris bungei
ReferenceChoudhary,Chem.Pharm.Bull.,50,(2002),1295