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CHEBI:748264 - semotiadil

Default Structure
ChEBI IDCHEBI:748264
ChEBI Namesemotiadil
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC29H32N2O6S
Net Charge0
Average Mass536.650
Monoisotopic Mass536.19811
SMILESCOc1ccc(OCCCN(C)CCOc2ccc3c(c2)OCO3)c([C@H]2Sc3ccccc3N(C)C2=O)c1
InChIInChI=1S/C29H32N2O6S/c1-30(14-16-34-21-10-12-25-26(18-21)37-19-36-25)13-6-15-35-24-11-9-20(33-3)17-22(24)28-29(32)31(2)23-7-4-5-8-27(23)38-28/h4-5,7-12,17-18,28H,6,13-16,19H2,1-3H3/t28-/m1/s1
InChIKeyRKXVEXUAWGRFNP-MUUNZHRXSA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
semotiadil (CHEBI:748264) is a benzothiazine (CHEBI:46899)
INN  Source
semotiadilWHO MedNet
Synonyms  Source
SD-3211ChEMBL
SesamodilChEMBL
Citations