input word = C00058828

Metabolite InformationStructural formula
Name Allyl isothiocyanate
Formula C4H5NS
Mw 99.0142699
CAS RN 57-06-7
C_ID C00058828
InChIKey ZOJBYZNEUISWFT-UHFFFAOYSA-N
InChICode InChI=1S/C4H5NS/c1-2-3-5-4-6/h2H,1,3H2
SMILES C=CCN=C=S
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlliaceaeAllium sativum Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeCruciferaeCapsella bursa-pastoris Ref.
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