input word = C00001242

Metabolite InformationStructural formula
Name Allicin
Formula C6H10OS2
Mw 162.0173064
CAS RN 539-86-6
C_ID C00001242 ,
InChIKey JDLKFOPOAOFWQN-UHFFFAOYNA-N
InChICode InChI=1S/C6H10OS2/c1-3-5-8-9(7)6-4-2/h3-4H,1-2,5-6H2/t9-/m0/s1
SMILES C=CC[S@@](=O)SCC=C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlliaceaeAllium cepa Ref.
PlantaeAlliaceaeAllium fistulosum Ref.
PlantaeAlliaceaeAllium obliquum Ref.
PlantaeAlliaceaeAllium sativum Ref.
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