input word = C00059242

Metabolite InformationStructural formula
Name (+)-3-Methyl-2-butenoic acid, 1-[(7-methoxy-2-oxo-2H-1-benzopyran-8-yl)carbonyl]-2-methylpropyl ester
Formula C20H22O6
Mw 358.14163844
CAS RN 112667-53-5
C_ID C00059242
InChIKey DYGOLEKLQJWOGJ-UHFFFAOYNA-N
InChICode InChI=1/C20H22O6/c1-11(2)10-16(22)26-19(12(3)4)18(23)17-14(24-5)8-6-13-7-9-15(21)25-20(13)17/h6-10,12,19H,1-5H3
SMILES COc1ccc2ccc(=O)oc2c1C(=O)C(OC(=O)C=C(C)C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya paniculata Ref.
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OrganismMurraya paniculata
Referencehttps://doi.org/10.1248/cpb.35.4277