input word = C00050983

Metabolite InformationStructural formula
Name Isopropyl isothiocyanate
Formula C4H7NS
Mw 101.02991996
CAS RN 2253-73-8
C_ID C00050983
InChIKey VHBFEIBMZHEWSX-UHFFFAOYSA-N
InChICode InChI=1S/C4H7NS/c1-4(2)5-3-6/h4H,1-2H3
SMILES CC(C)N=C=S
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeBrassica juncea Ref.
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