input word = C00052668

Metabolite InformationStructural formula
Name 3,5-Octadien-2-one
Formula C8H12O
Mw 124.08881501
CAS RN 38284-27-4
C_ID C00052668
InChIKey LWRKMRFJEUFXIB-YTXTXJHMSA-N
InChICode InChI=1S/C8H12O/c1-3-4-5-6-7-8(2)9/h4-7H,3H2,1-2H3/b5-4+,7-6+
SMILES CC/C=C/C=C/C(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeMatricaria recutita Ref.
PlantaeCeratophyllaceaeCeratophyllum demersum Ref.
PlantaeCruciferaeCapsella bursa-pastoris Ref.
PlantaeSolanaceaeMandragora autumnalis Ref.
--Caffea sp. Ref.
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