Molecular structure
/ COMPOUND
1-isothiocyanato-4-methylsulfanylbutane
Molecular ID 78160Formula C6H11NS2MW 161.360 food sources
Sensory signature
How this molecule tastes and smells · gold is measured, dashed is a model estimate
measuredpredicted
foularoma · measuredsharparoma · measuredradisharoma · measuredcabbagearoma · measuredpungentaroma · measuredsulphuraroma · measuredsickeningaroma · measured
Bioactivity signal
Structure-activity model estimate · not measured
50%
predicted bioactivity probability
medium confidencelow structural similarity to training set
Biochemical reactions
Metabolic reactions from curated biochemical databases · peer-reviewed
productview reaction →
(Z)-4-methylsulfanylbutyl-N-(sulfonatooxy)methanimidothioate = 4-methylsulfanylbutyl isothionate + sulfate + H(+)
Foods containing this compound
Cabbage
View ingredient ->
Cabbage, green, cooked with oil
View ingredient ->
Cabbage, red, raw
View ingredient ->
Cabbage, red, boiled, drained
View ingredient ->
Cabbage, savoy, raw
View ingredient ->
Cabbage, savoy, boiled, drained
View ingredient ->
Cabbage, Chinese (pe-tsai), boiled, drained
View ingredient ->
Cabbage, raw
View ingredient ->
Verified Data
Compound identity and culinary context are continuously cross-referenced across open scientific databases and maintained by Foodgeist's enrichment pipeline.
The Geist can be wrong. Some flavor, taste, and pairing values are model-predicted, not lab-measured.
