input word = C00056322

Metabolite InformationStructural formula
Name 3-Methyl-5-propyl-1,2-dithiolane
Formula C7H14S2
Mw 162.05369191
CAS RN 1006684-14-5
C_ID C00056322
InChIKey MKTVKFCYHOBUOZ-UHFFFAOYSA-N
InChICode InChI=1S/C7H14S2/c1-3-4-7-5-6(2)8-9-7/h6-7H,3-5H2,1-2H3
SMILES CC1CC(CCC)SS1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeCapsicum annuum Ref.
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OrganismCapsicum annuum
ReferenceNaef, R. et al., J. Agric. Food Chem., 2008, 56, 517-527 (isol, synth, pmr, cmr, ms)