EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:40010 - 4-(1H-IMIDAZOL-4-YL)-3-(5-ETHYL-2,4-DIHYDROXY-PHENYL)-1H-PYRAZOLE

Default Structure
ChEBI IDCHEBI:40010
ChEBI Name4-(1H-IMIDAZOL-4-YL)-3-(5-ETHYL-2,4-DIHYDROXY-PHENYL)-1H-PYRAZOLE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC14H14N4O2
Net Charge0
Average Mass270.292
Monoisotopic Mass270.11168
SMILES[H]Oc1c([H])c(O[H])c(C([H])([H])C([H])([H])[H])c([H])c1-c1nn([H])c([H])c1-c1nc([H])n([H])c1[H]
InChIInChI=1S/C14H14N4O2/c1-2-8-3-9(13(20)4-12(8)19)14-10(5-17-18-14)11-6-15-7-16-11/h3-7,19-20H,2H2,1H3,(H,15,16)(H,17,18)
InChIKeyATORUNMAUREKMH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(1H-IMIDAZOL-4-YL)-3-(5-ETHYL-2,4-DIHYDROXY-PHENYL)-1H-PYRAZOLE (CHEBI:40010) is a unclassifieds (CHEBI:27189)
Synonyms  Source
4-(1H-IMIDAZOL-4-YL)-3-(5-ETHYL-2,4-DIHYDROXY-PHENYL)-1H-PYRAZOLEPDBeChem
4-ethyl-6-[4-(1H-imidazol-4-yl)-1H-pyrazol-3-yl]benzene-1,3-diolPDBeChem
Manual XrefsDatabases
43PPDBeChem