input word = C00050960

Metabolite InformationStructural formula
Name Isomurralonginol acetate
Formula C17H18O5
Mw 302.11542369
CAS RN 139115-59-6
C_ID C00050960
InChIKey KJRYZFDEVYMOEY-UHFFFAOYNA-N
InChICode InChI=1S/C17H18O5/c1-10(2)13(9-21-11(3)18)16-14(20-4)7-5-12-6-8-15(19)22-17(12)16/h5-8,13H,1,9H2,2-4H3
SMILES C=C(C)C(COC(C)=O)c1c(OC)ccc2ccc(=O)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya paniculata var.exotica Ref.
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