SEQ2FUN

BioLiP

PDB CCD ID: TN1
Number of entries in BioLiP: 1
Chemical formula: C10 H12 O
InChI: InChI=1S/C10H12O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3,5,7,11H,1-2,4,6H2
InChIKey: SCWNNOCLLOHZIG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341Oc1cccc2CCCCc12
ACDLabs 10.04Oc1cccc2c1CCCC2
OpenEye OEToolkits 1.5.0c1cc2c(c(c1)O)CCCC2
Name:5,6,7,8-TETRAHYDRONAPHTHALEN-1-OL
ChEMBL: CHEMBL449132
ZINC: ZINC000003860772
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).