WZB-117 (CHEBI:229781)

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ChEBI Name	WZB-117

ChEBI ID	CHEBI:229781

Definition	A 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.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	Doug Howe

Supplier Information

Download	Molfile XML SDF

Formula

C20H13FO6

Net Charge

Average Mass

368.316

Monoisotopic Mass

368.06962

InChI

InChI=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

InChIKey

FRSWCCBXIHFKKY-UHFFFAOYSA-N

SMILES

OC1=CC=CC(=C1)C(=O)OC1=C(OC(=O)C2=CC(O)=CC=C2)C(F)=CC=C1

Roles Classification
Biological Role(s):	glucose transporter 1 inhibitor Any glucose transporter inhibitor that interferes with the action of glucose transporter 1.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. radiosensitizing agent A drug that makes increases the sensitivity of tumour cells to radiation therapy.

ChEBI Ontology
Outgoing	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	Sources
3-fluoro-1,2-phenylene bis(3-hydroxybenzoate)	IUPAC
3-hydroxy-benzoic acid 1,1'-(3-fluoro-1,2-phenylene) ester	ChEBI
WZB 117	ChEBI
WZB117	SUBMITTER

Registry Number	Type	Source
1223397-11-2	CAS Registry Number	ChEBI

Last Modified

15 March 2024