SEQ2FUN

BioLiP

PDB CCD ID: EFS
Number of entries in BioLiP: 8
Chemical formula: C2 H7 O4 P
InChI: InChI=1S/C2H7O4P/c1-2-6-7(3,4)5/h2H2,1H3,(H2,3,4,5)
InChIKey: ZJXZSIYSNXKHEA-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=P(O)(O)OCC
OpenEye OEToolkits 1.5.0CCOP(=O)(O)O
CACTVS 3.341CCO[P](O)(O)=O
Name:ETHYL DIHYDROGEN PHOSPHATE
DrugBank: DB03822
ZINC: ZINC000005575803
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).