SEQ2FUN

BioLiP

PDB CCD ID: A1ADJ
Number of entries in BioLiP: 1
Chemical formula: C6 H8
InChI: InChI=1S/C6H8/c1-2-4-6-5-3-1/h1-2,5-6H,3-4H2
InChIKey: UVJHQYIOXKWHFD-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01C1=CCC=CC1
CACTVS 3.385
OpenEye OEToolkits 2.0.7		C1C=CCC=C1
Name:cyclohexa-1,4-diene
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).