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CHEBI:754759 - thihexinol

Default Structure
ChEBI IDCHEBI:754759
ChEBI Namethihexinol
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC18H26NOS2
Net Charge+1
Average Mass336.546
Monoisotopic Mass336.14503
SMILESC[N+](C)(C)C1CCC(C(O)(c2cccs2)c2cccs2)CC1
InChIInChI=1S/C18H26NOS2/c1-19(2,3)15-10-8-14(9-11-15)18(20,16-6-4-12-21-16)17-7-5-13-22-17/h4-7,12-15,20H,8-11H2,1-3H3/q+1
InChIKeyVROKFRFJNZCFMH-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
thihexinol (CHEBI:754759) is a amine (CHEBI:32952)