Summary

IMPPAT Phytochemical identifier: IMPHY015906

Phytochemical name: Propenyl propyl trisulfide

Synonymous chemical names:
propenyl propyl trisulphide

External chemical identifiers:
CID:181104

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Chemical structure information

SMILES:
CCCSSSC=CC

InChI:
InChI=1S/C6H12S3/c1-3-5-7-9-8-6-4-2/h3,5H,4,6H2,1-2H3

InChIKey:
CKVNYTRYOFXVGM-UHFFFAOYSA-N

DeepSMILES:
CCCSSSC=CC

Functional groups:
CC=CSSSC

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organosulfur compounds

ClassyFire Class: Organic trisulfides

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 2.06

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Chemical structure download