input word = C00054105

Metabolite InformationStructural formula
Name Coumarone
Formula C8H6O
Mw 118.04186481
CAS RN 271-89-6
C_ID C00054105
InChIKey IANQTJSKSUMEQM-UHFFFAOYSA-N
InChICode InChI=1S/C8H6O/c1-2-4-8-7(3-1)5-6-9-8/h1-6H
SMILES C12=CC=CC=C1OC=C2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeGentianaceaeGentiana lutea Ref.
PlantaePoaceaeCoix lachryma-jobi Ref.
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