SEQ2FUN

BioLiP

PDB CCD ID: 3QD
Number of entries in BioLiP: 1
Chemical formula: C2 H7 B O2
InChI: InChI=1S/C2H7BO2/c1-2-3(4)5/h4-5H,2H2,1H3
InChIKey: PAVZHTXVORCEHP-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.9.2B(CC)(O)O
CACTVS 3.385CCB(O)O
ACDLabs 12.01OB(O)CC
Name:ethylboronic acid
ChEMBL: CHEMBL3218995
ZINC: ZINC000169743324
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).