CHEBI:229781 - WZB-117

ChEBI IDCHEBI:229781
ChEBI NameWZB-117
Stars
DefinitionA diester resulting from the formal condensation of the two hydroxy groups of 3-fluorocatechol with the carboxy groups of 3-hydroxybenzoic acid. It is an inhibitor of glucose transporter 1 (GLUT1) that suppresses tumour growth in mouse xenograft models.
Last Modified15 March 2024
Submitterdoughowe
DownloadsMolfile
FormulaC20H13FO6
Net Charge0
Average Mass368.316
Monoisotopic Mass368.06962
SMILESO=C(Oc1cccc(F)c1OC(=O)c1cccc(O)c1)c1cccc(O)c1
InChIInChI=1S/C20H13FO6/c21-16-8-3-9-17(26-19(24)12-4-1-6-14(22)10-12)18(16)27-20(25)13-5-2-7-15(23)11-13/h1-11,22-23H
InChIKeyFRSWCCBXIHFKKY-UHFFFAOYSA-N
Roles Classification
Biological Role:
glucose transporter 1 inhibitor  Any glucose transporter inhibitor that interferes with the action of glucose transporter 1.
Applications:
radiosensitizing agent  A drug that makes increases the sensitivity of tumour cells to radiation therapy.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
WZB-117 (CHEBI:229781) has functional parent 3-fluorocatechol (CHEBI:39876)
WZB-117 (CHEBI:229781) has functional parent 3-hydroxybenzoic acid (CHEBI:30764)
WZB-117 (CHEBI:229781) has role antineoplastic agent (CHEBI:35610)
WZB-117 (CHEBI:229781) has role glucose transporter 1 inhibitor (CHEBI:229783)
WZB-117 (CHEBI:229781) has role radiosensitizing agent (CHEBI:132992)
WZB-117 (CHEBI:229781) is a benzoate ester (CHEBI:36054)
WZB-117 (CHEBI:229781) is a diester (CHEBI:51307)
WZB-117 (CHEBI:229781) is a monofluorobenzenes (CHEBI:83575)
WZB-117 (CHEBI:229781) is a phenols (CHEBI:33853)
IUPAC Name 
3-fluorobenzene-1,2-diyl bis(3-hydroxybenzoate)
Synonyms  Source
WZB117SUBMITTER
3-fluoro-1,2-phenylene bis(3-hydroxybenzoate)IUPAC
3-hydroxy-benzoic acid 1,1'-(3-fluoro-1,2-phenylene) esterChEBI
WZB 117ChEBI
Manual XrefsDatabases
DB16764DrugBank
Registry NumbersSources
CAS:1223397-11-2ChEBI
Citations