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CHEBI:47629 - 9-BUTYL-8-(2-CHLORO-3,4,5-TRIMETHOXY-BENZYL)-9H-PURIN-6-YLAMINE

Default Structure
ChEBI IDCHEBI:47629
ChEBI Name9-BUTYL-8-(2-CHLORO-3,4,5-TRIMETHOXY-BENZYL)-9H-PURIN-6-YLAMINE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC19H24ClN5O3
Net Charge0
Average Mass405.886
Monoisotopic Mass405.15677
SMILES[H]c1nc(N([H])[H])c2nc(C([H])([H])c3c([H])c(OC([H])([H])[H])c(OC([H])([H])[H])c(OC([H])([H])[H])c3Cl)n(C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])c2n1
InChIInChI=1S/C19H24ClN5O3/c1-5-6-7-25-13(24-15-18(21)22-10-23-19(15)25)9-11-8-12(26-2)16(27-3)17(28-4)14(11)20/h8,10H,5-7,9H2,1-4H3,(H2,21,22,23)
InChIKeyIVPCTHKPOPQMSX-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
9-BUTYL-8-(2-CHLORO-3,4,5-TRIMETHOXY-BENZYL)-9H-PURIN-6-YLAMINE (CHEBI:47629) is a unclassifieds (CHEBI:27189)
Synonyms  Source
9-butyl-8-(2-chloro-3,4,5-trimethoxybenzyl)-9H-purin-6-aminePDBeChem
9-BUTYL-8-(2-CHLORO-3,4,5-TRIMETHOXY-BENZYL)-9H-PURIN-6-YLAMINEPDBeChem
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