CHEBI:756163 - fenoctimine sulfate

ChEBI IDCHEBI:756163
ChEBI Namefenoctimine sulfate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaH2O.H2O4S.C27H38N2.H2O4S.C27H38N2
Net Charge0
Average Mass995.403
Monoisotopic Mass994.55232
SMILESCCCCCCCC/N=C/N1CCC(C(c2ccccc2)c2ccccc2)CC1.CCCCCCCC/N=C/N1CCC(C(c2ccccc2)c2ccccc2)CC1.O.O=S(=O)(O)O.O=S(=O)(O)O
InChIInChI=1S/2C27H38N2.2H2O4S.H2O/c2*1-2-3-4-5-6-13-20-28-23-29-21-18-26(19-22-29)27(24-14-9-7-10-15-24)25-16-11-8-12-17-25;2*1-5(2,3)4;/h2*7-12,14-17,23,26-27H,2-6,13,18-22H2,1H3;2*(H2,1,2,3,4);1H2/b2*28-23+;;;
InChIKeyDZLXKTCZFYOEES-FZGZZAAPSA-N
ChEBI Ontology
Outgoing Relation(s)
fenoctimine sulfate (CHEBI:756163) is a diarylmethane (CHEBI:51614)
Synonyms  Source
Fenoctimine sulfateChEMBL
Fenoctimine sulfate hemihydrateChEMBL
Fenoctimine sulphateChEMBL
MCN-4097-12-98ChEMBL