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BioLiP Library

PDB CCD ID: OZM
Number of entries in BioLiP: 1
Chemical formula: C17 H14 O3
InChI: InChI=1S/C17H14O3/c18-17(19)10-14-11-20-16-9-13(6-7-15(14)16)8-12-4-2-1-3-5-12/h1-7,9,11H,8,10H2,(H,18,19)
InChIKey: NANLKTVMZIVCBJ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1ccc(cc1)Cc2ccc3c(c2)occ3CC(=O)O
CACTVS 3.385OC(=O)Cc1coc2cc(Cc3ccccc3)ccc12
ACDLabs 12.01C(c1ccc2c(CC(O)=O)coc2c1)c3ccccc3
Name:(6-benzyl-1-benzofuran-3-yl)acetic acid
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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