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CHEBI:752097 - cycotiamine

Default Structure
ChEBI IDCHEBI:752097
ChEBI Namecycotiamine
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC13H16N4O3S
Net Charge0
Average Mass308.363
Monoisotopic Mass308.09431
SMILESC/C(=C1\CCOC(=O)S1)N(C=O)Cc1cnc(C)nc1N
InChIInChI=1S/C13H16N4O3S/c1-8(11-3-4-20-13(19)21-11)17(7-18)6-10-5-15-9(2)16-12(10)14/h5,7H,3-4,6H2,1-2H3,(H2,14,15,16)/b11-8-
InChIKeyLLJDJQYGZBQFIF-FLIBITNWSA-N
ChEBI Ontology
Outgoing Relation(s)
cycotiamine (CHEBI:752097) is a organosulfur heterocyclic compound (CHEBI:38106)
cycotiamine (CHEBI:752097) is a oxacycle (CHEBI:38104)
INNs  Source
cicotiaminaWHO MedNet
cycotiamineWHO MedNet
Synonyms  Source
CarbothiamineChEMBL
CometamineChEMBL
CommetaminChEMBL
Cycothiamin(e)ChEMBL