input word = C00054899

Metabolite InformationStructural formula
Name 1-Cyano-8-(methylthio)octane
Formula C10H19NS
Mw 185.12382034
CAS RN 58214-94-1
C_ID C00054899
InChIKey KQKRRHTVZQEXBX-UHFFFAOYSA-N
InChICode InChI=1S/C10H19NS/c1-12-10-8-6-4-2-3-5-7-9-11/h2-8,10H2,1H3
SMILES N#CCCCCCCCCSC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeNasturtium officinale Ref.
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OrganismNasturtium officinale
ReferenceMacleod, A.J. et al., Phytochemistry, 1977, 16, 907 (S-Me nitrile)