input word = C00000138

Metabolite InformationStructural formula
Name (R)-8-Methylsulfinyloctyl isothiocyanate
Formula C10H19NOS2
Mw 233.0908057
CAS RN 31456-68-5
C_ID C00000138 ,
InChIKey BCRXKWOQVFKZAG-UHFFFAOYNA-N
InChICode InChI=1S/C10H19NOS2/c1-14(12)9-7-5-3-2-4-6-8-11-10-13/h2-9H2,1H3/t14-/m1/s1
SMILES C[S@@](=O)CCCCCCCCN=C=S
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys L-Arg L-Ala
Organism
Kingdom Family Species Reference
PlantaeCruciferaeRorippa indica (L.) Hiern. Ref.
PlantaeCruciferaeRorippa islandica (Oeder) Borbas Ref.
PlantaeCruciferaeRorippa sylvestris Ref.
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