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CHEBI:75307 - BW B70C

ChEBI IDCHEBI:75307
ChEBI NameBW B70C
Stars
DefinitionA hydroxamic acid that is urea in which both the hydrogens attached to one of the nitrogens are replaced by a hydroxy and a (1E)-1-[3-(4-fluorophenoxy)phenyl]but-1-en-3-yl group. A selective inhibitor of arachidonate 5-lipoxygenase, it can be used for the treatment of asthma.
Last Modified23 August 2013
Submitternamrata
DownloadsMolfile
FormulaC17H17FN2O3
Net Charge0
Average Mass316.332
Monoisotopic Mass316.12232
SMILESCC(/C=C/c1cccc(Oc2ccc(F)cc2)c1)N(O)C(N)=O
InChIInChI=1S/C17H17FN2O3/c1-12(20(22)17(19)21)5-6-13-3-2-4-16(11-13)23-15-9-7-14(18)8-10-15/h2-12,22H,1H3,(H2,19,21)/b6-5+
InChIKeyUAIYNMRLUHHRMF-AATRIKPKSA-N
Roles Classification
Biological Role:
EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor  A lipoxygenase inhibitor that interferes with the action of arachidonate 5-lipoxygenase (EC 1.13.11.34).
ChEBI Ontology
Outgoing Relation(s)
BW B70C (CHEBI:75307) has role EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor (CHEBI:64964)
BW B70C (CHEBI:75307) is a aromatic ether (CHEBI:35618)
BW B70C (CHEBI:75307) is a hydroxamic acid (CHEBI:24650)
BW B70C (CHEBI:75307) is a organofluorine compound (CHEBI:37143)
BW B70C (CHEBI:75307) is a ureas (CHEBI:47857)
IUPAC Name 
1-{(3E)-4-[3-(4-fluorophenoxy)phenyl]but-3-en-2-yl}-1-hydroxyurea
Synonyms  Source
(E)-N-(3-(3-(4-Fluorophenoxy)phenyl)-1-(R,S)-methylprop-2-enyl)-N-hydroxyureaChEBI
70CChemIDplus
BW-B70CChEBI
Registry NumbersSources
Reaxys:8853259Reaxys
CAS:134470-38-5ChemIDplus
Citations