input word = C00033052

Metabolite InformationStructural formula
Name Irisoid B
Formula C18H14O7
Mw 342.0739528
CAS RN 377724-76-0
C_ID C00033052 ,
InChIKey QVHFICYAHDSZBK-UHFFFAOYSA-N
InChICode InChI=1S/C18H14O7/c1-22-11-6-10-13(14(20)16(11)23-2)15(21)18-17(25-10)12-8(7-24-18)4-3-5-9(12)19/h3-6,19-20H,7H2,1-2H3
SMILES COc1cc2oc3c(c(=O)c2c(O)c1OC)OCc1cccc(O)c1-3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeIris bungei Ref.
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