CHEBI:79898 - 6-(2-Chloroallylthio)purine

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-(2-Chloroallylthio)purine
ChEBI ID CHEBI:79898
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C8H7ClN4S
Net Charge 0
Average Mass 226.68600
Monoisotopic Mass 226.00800
InChI InChI=1S/C8H7ClN4S/c1-5(9)2-14-8-6-7(11-3-10-6)12-4-13-8/h3-4H,1-2H2,(H,10,11,12,13)
InChIKey DHCQTENXTQSPQS-UHFFFAOYSA-N
SMILES ClC(=C)CSc1ncnc2nc[nH]c12
ChEBI Ontology
Outgoing 6-(2-Chloroallylthio)purine (CHEBI:79898) is a thiopurine (CHEBI:35666)
Manual Xref Database
C15397 KEGG COMPOUND
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