input word = C00033053

Metabolite InformationStructural formula
Name Irisoid C
Formula C18H14O7
Mw 342.0739528
CAS RN 377724-79-3
C_ID C00033053 ,
InChIKey HGMYEZICBOKCLR-UHFFFAOYSA-N
InChICode InChI=1S/C18H14O7/c1-22-15-10(20)6-11-13(16(15)23-2)14(21)18-17(25-11)12-8(7-24-18)4-3-5-9(12)19/h3-6,19-20H,7H2,1-2H3
SMILES COc1c(O)cc2oc3c(c(=O)c2c1OC)OCc1cccc(O)c1-3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeIris bungei Ref.
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