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BioLiP Library

PDB CCD ID: 9AC
Number of entries in BioLiP: 0
Chemical formula: C14 H9 N O2
InChI: InChI=1S/C14H9NO2/c16-14(17)13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H,16,17)
InChIKey: IYRYQBAAHMBIFT-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385OC(=O)c1c2ccccc2nc3ccccc13
OpenEye OEToolkits 2.0.7c1ccc2c(c1)c(c3ccccc3n2)C(=O)O
ACDLabs 10.04O=Cc1c3c(nc2c1cccc2)cccc3
Name:9-ACRIDINECARBONYL;
9-ACRIDINOYL
ZINC: ZINC000004100749
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)(download the PDF file).
  • 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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