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CHEBI:750003 - r(+)xk469

Default Structure
ChEBI IDCHEBI:750003
ChEBI Namer(+)xk469
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC17H13ClN2O4
Net Charge0
Average Mass344.754
Monoisotopic Mass344.05638
SMILES[H][C@](C)(Oc1ccc(Oc2cnc3ccc(Cl)cc3n2)cc1)C(=O)O
InChIInChI=1S/C17H13ClN2O4/c1-10(17(21)22)23-12-3-5-13(6-4-12)24-16-9-19-14-7-2-11(18)8-15(14)20-16/h2-10H,1H3,(H,21,22)/t10-/m1/s1
InChIKeyNUQZXROIVGBRGR-SNVBAGLBSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
r(+)xk469 (CHEBI:750003) has role antineoplastic agent (CHEBI:35610)
r(+)xk469 (CHEBI:750003) is a aromatic ether (CHEBI:35618)
r(+)xk469 (CHEBI:750003) is a carboxylic acid (CHEBI:33575)
Synonym  Source
R(+)xk469ChEMBL
Citations