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CHEBI:6729 - Melarsoprol

ChEBI IDCHEBI:6729
ChEBI NameMelarsoprol
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC12H15AsN6OS2
Net Charge0
Average Mass398.349
Monoisotopic Mass397.99647
SMILESNc1nc(N)nc(Nc2ccc([As]3SCC(CO)S3)cc2)n1
InChIInChI=1S/C12H15AsN6OS2/c14-10-17-11(15)19-12(18-10)16-8-3-1-7(2-4-8)13-21-6-9(5-20)22-13/h1-4,9,20H,5-6H2,(H5,14,15,16,17,18,19)
InChIKeyJCYZMTMYPZHVBF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Melarsoprol (CHEBI:6729) is a triazines (CHEBI:38102)
Synonyms  Source
MelarsoprolKEGG COMPOUND
arsobalDrugCentral
melarsaprolDrugCentral
melarsen BDrugCentral
Manual XrefsDatabases
C08001KEGG COMPOUND
D00832KEGG DRUG
3336DrugCentral
Registry NumbersSources
CAS:494-79-1KEGG COMPOUND