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BioLiP

PDB CCD ID: SGZ
Number of entries in BioLiP: 0
Chemical formula: C12 H10 O
InChI: InChI=1S/C12H10O/c13-9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7,9H,8H2
InChIKey: CCHAJZURXPPHJU-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385O=CCc1cccc2ccccc12
OpenEye OEToolkits 2.0.7c1ccc2c(c1)cccc2CC=O
Name:2-naphthalen-1-ylethanal
ZINC: ZINC000039248410
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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