input word = C00025420

Metabolite InformationStructural formula
Name Glycolone
Formula C16H19NO3
Mw 273.13649348
CAS RN 41303-26-8
C_ID C00025420 ,
InChIKey XEUCQOBUZPQUMQ-UHFFFAOYSA-N
InChICode InChI=1S/C16H19NO3/c1-10(2)8-9-12-15(20-4)11-6-5-7-13(19-3)14(11)17-16(12)18/h5-8H,9H2,1-4H3,(H,17,18)
SMILES c1ccc2c(c1OC)[nH]c(=O)c(c2OC)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRutaceaeGlycosmis pentaphylla Ref.
PlantaeRutaceaeZanthoxylum scandens Ref.
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