input word = C00010046

Metabolite InformationStructural formula
Name Isorobustin
Formula C22H18O7
Mw 394.10525293
CAS RN 55607-51-7
C_ID C00010046 ,
InChIKey IPSRAWJCFVMJBQ-UHFFFAOYSA-N
InChICode InChI=1S/C22H18O7/c1-22(2)7-6-12-14(29-22)9-16(25-3)18-19(23)17(21(24)28-20(12)18)11-4-5-13-15(8-11)27-10-26-13/h4-9,23H,10H2,1-3H3
SMILES c12cc(c3c(c1C=CC(O2)(C)C)oc(=O)c(c3O)c1ccc2c(c1)OCO2)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeDerris spruceana Ref.
zoom in