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BioLiP

PDB CCD ID: NOA
Number of entries in BioLiP: 1
Chemical formula: C12 H10 O3
InChI: InChI=1S/C12H10O3/c13-12(14)8-15-11-7-3-5-9-4-1-2-6-10(9)11/h1-7H,8H2,(H,13,14)
InChIKey: GHRYSOFWKRRLMI-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1ccc2c(c1)cccc2OCC(=O)O
ACDLabs 10.04O=C(O)COc2cccc1ccccc12
CACTVS 3.341OC(=O)COc1cccc2ccccc12
Name:NAPHTHYLOXYACETIC ACID
ChEMBL: CHEMBL1234781
DrugBank: DB08286
ZINC: ZINC000000038389
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).
  • Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).

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