SEQ2FUN

BioLiP

PDB CCD ID: 3OH
Number of entries in BioLiP: 23
Chemical formula: C3 H6 O3
InChI: InChI=1S/C3H6O3/c4-2-1-3(5)6/h4H,1-2H2,(H,5,6)
InChIKey: ALRHLSYJTWAHJZ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341OCCC(O)=O
ACDLabs 10.04O=C(O)CCO
OpenEye OEToolkits 1.5.0C(CO)C(=O)O
Name:3-HYDROXY-PROPANOIC ACID
ChEMBL: CHEMBL1205969
DrugBank: DB03688
ZINC: ZINC000000895452
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).