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BioLiP

PDB CCD ID: 3HY
Number of entries in BioLiP: 1
Chemical formula: C7 H8 O2
InChI: InChI=1S/C7H8O2/c8-5-6-2-1-3-7(9)4-6/h1-4,8-9H,5H2
InChIKey: OKVJCVWFVRATSG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385OCc1cccc(O)c1
OpenEye OEToolkits 1.7.6c1cc(cc(c1)O)CO
ACDLabs 12.01OCc1cc(O)ccc1
Name:3-(hydroxymethyl)phenol
ChEMBL: CHEMBL3337531
ZINC: ZINC000000388761
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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