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CHEBI:34977 - Sipatrigine

ChEBI IDCHEBI:34977
ChEBI NameSipatrigine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC15H16Cl3N5
Net Charge0
Average Mass372.687
Monoisotopic Mass371.04713
SMILESCN1CCN(c2ncc(-c3cc(Cl)cc(Cl)c3Cl)c(N)n2)CC1
InChIInChI=1S/C15H16Cl3N5/c1-22-2-4-23(5-3-22)15-20-8-11(14(19)21-15)10-6-9(16)7-12(17)13(10)18/h6-8H,2-5H2,1H3,(H2,19,20,21)
InChIKeyPDOCBJADCWMDGL-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Sipatrigine (CHEBI:34977) is a pyrimidines (CHEBI:39447)
Synonyms  Source
SipatrigineKEGG COMPOUND
BW619C89KEGG COMPOUND
Manual XrefsDatabases
C13852KEGG COMPOUND
Registry NumbersSources
CAS:130800-90-7KEGG COMPOUND