EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:39701 - 4-(6-HYDROXY-BENZO[D]ISOXAZOL-3-YL)BENZENE-1,3-DIOL

Default Structure
ChEBI IDCHEBI:39701
ChEBI Name4-(6-HYDROXY-BENZO[D]ISOXAZOL-3-YL)BENZENE-1,3-DIOL
Stars
Last Modified17 October 2009
DownloadsMolfile
FormulaC13H9NO4
Net Charge0
Average Mass243.218
Monoisotopic Mass243.05316
SMILES[H]Oc1c([H])c([H])c(-c2noc3c([H])c(O[H])c([H])c([H])c23)c(O[H])c1[H]
InChIInChI=1S/C13H9NO4/c15-7-1-3-9(11(17)5-7)13-10-4-2-8(16)6-12(10)18-14-13/h1-6,15-17H
InChIKeyNBTXJDAHLMMIGY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-(6-HYDROXY-BENZO[D]ISOXAZOL-3-YL)BENZENE-1,3-DIOL (CHEBI:39701) is a unclassifieds (CHEBI:27189)
Synonyms  Source
4-(6-hydroxy-1,2-benzisoxazol-3-yl)benzene-1,3-diolPDBeChem
4-(6-HYDROXY-BENZO[D]ISOXAZOL-3-YL)BENZENE-1,3-DIOLPDBeChem
Manual XrefsDatabases
272PDBeChem