input word = C00061190

Metabolite InformationStructural formula
Name 2,1-Benzisothiazole
Formula C7H5NS
Mw 135.0142699
CAS RN 271-61-4
C_ID C00061190
InChIKey CSNIZNHTOVFARY-UHFFFAOYSA-N
InChICode InChI=1S/C7H5NS/c1-2-4-7-6(3-1)5-8-9-7/h1-5H
SMILES c1ccc2sncc2c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeApium graveolens Ref.
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OrganismApium graveolens
Referencehttps://doi.org/10.1016/j.foodres.2018.12.054