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CHEBI:7986 - Pentoxifylline

ChEBI IDCHEBI:7986
ChEBI NamePentoxifylline
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC13H18N4O3
Net Charge0
Average Mass278.312
Monoisotopic Mass278.13789
SMILESCC(=O)CCCCn1c(=O)c2c(ncn2C)n(C)c1=O
InChIInChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3
InChIKeyBYPFEZZEUUWMEJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Pentoxifylline (CHEBI:7986) is a oxopurine (CHEBI:25810)
Synonyms  Source
PentoxifyllineKEGG COMPOUND
dimethyloxohexylxanthineDrugCentral
azupentatDrugCentral
pentoxifyllinDrugCentral
oxpentifyllineDrugCentral
Manual XrefsDatabases
C07424KEGG COMPOUND
D00501KEGG DRUG
PNXPDBeChem
LSM-3285LINCS
2099DrugCentral
HMDB0014944HMDB
Registry NumbersSources
CAS:6493-05-6KEGG COMPOUND