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.
zoom in



OrganismBrassica juncea
ReferenceEdited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979)