Allyl isothiocyanate

Basic Information


CAS ID: 57-06-7
Molecular Formula: C4H5NS
Molecular Weight: 99.2 g/mol
Monoisotopic Mass: 99.0143 g/mol
Class: Small Molecule
Natural Product: No
Other Names: MUSTARD OIL | ALLYL ISOTHIOCYANATE
Analysis: Drug repositioning mechanism analysis

N S


Compound Structure and Identifier


InChI: InChI=1S/C4H5NS/c1-2-3-5-4-6/h2H,1,3H2 See All
InChI Key: ZOJBYZNEUISWFT-UHFFFAOYSA-N
Smiles: C=CCN=C=S See All
Molfile: Download


Related Target


Target ID Name Interaction
T0168 Transient receptor potential cation channel subfamily A member 1 agonist

Related Fibrosis Property


Reference Record 1

PubMed ID 29552620 Target ID T0168
Uniprot ID Transient receptor potential cation channel subfamily A member 1 Name Transient receptor potential cation channel subfamily A member 1
Model vitro,mice Fibrosis Disease Intestinal fibrosis
Process I attenue inflammation
Process II
Process III prevenet collagen deposition
Mechanism

Related Link


PubChem: 5971
ChEMBL: CHEMBL233248