input word = C00050712

Metabolite InformationStructural formula
Name 3-Methylthiopropyl isothiocyanate
Iberverin
Formula C5H9NS2
Mw 147.01764075
CAS RN 505-79-3
C_ID C00050712
InChIKey LDKSCZJUIURGMW-UHFFFAOYSA-N
InChICode InChI=1S/C5H9NS2/c1-8-4-2-3-6-5-7/h2-4H2,1H3
SMILES CSCCCN=C=S
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBrassicaceaeWasabi japonica Ref.
PlantaeCruciferaeArmoracia lapathifolia Ref.
PlantaeCruciferaeBrassica juncea Ref.
--Rapharius sativus Ref.
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