input word = C00059126

Metabolite InformationStructural formula
Name Isomeranzin
Formula C15H16O4
Mw 260.104859
CAS RN 1088-17-1
C_ID C00059126
InChIKey OMOYQLRHKFGVGN-UHFFFAOYSA-N
InChICode InChI=1S/C15H16O4/c1-9(2)12(16)8-11-13(18-3)6-4-10-5-7-14(17)19-15(10)11/h4-7,9H,8H2,1-3H3
SMILES COc1ccc2ccc(=O)oc2c1CC(=O)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya paniculata Ref.
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