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CHEBI:42139 - 2-FLUORO-8-[(6-IODO-1,3-BENZODIOXOL-5-YL)METHYL]-9-[3-(ISOPROPYLAMINO)PROPYL]-9H-PURIN-6-AMINE

Default Structure
ChEBI IDCHEBI:42139
ChEBI Name2-FLUORO-8-[(6-IODO-1,3-BENZODIOXOL-5-YL)METHYL]-9-[3-(ISOPROPYLAMINO)PROPYL]-9H-PURIN-6-AMINE
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC19H22FIN6O2
Net Charge0
Average Mass512.327
Monoisotopic Mass512.08330
SMILES[H]c1c(I)c(C([H])([H])c2nc3c(N([H])[H])nc(F)nc3n2C([H])([H])C([H])([H])C([H])([H])N([H])C([H])(C([H])([H])[H])C([H])([H])[H])c([H])c2c1OC([H])([H])O2
InChIInChI=1S/C19H22FIN6O2/c1-10(2)23-4-3-5-27-15(24-16-17(22)25-19(20)26-18(16)27)7-11-6-13-14(8-12(11)21)29-9-28-13/h6,8,10,23H,3-5,7,9H2,1-2H3,(H2,22,25,26)
InChIKeyJPPCGDGMQGJGQK-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-FLUORO-8-[(6-IODO-1,3-BENZODIOXOL-5-YL)METHYL]-9-[3-(ISOPROPYLAMINO)PROPYL]-9H-PURIN-6-AMINE (CHEBI:42139) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-fluoro-8-[(6-iodo-1,3-benzodioxol-5-yl)methyl]-9-{3-[(1-methylethyl)amino]propyl}-9H-purin-6-aminePDBeChem
2-FLUORO-8-[(6-IODO-1,3-BENZODIOXOL-5-YL)METHYL]-9-[3-(ISOPROPYLAMINO)PROPYL]-9H-PURIN-6-AMINEPDBeChem
Manual XrefsDatabases
DZ8PDBeChem