BioLiP

PDB

BioLiP

PDB CCD ID:

WZT

Number of entries in BioLiP:

Chemical formula:

C7 H9 O4 P

InChI:

InChI=1S/C7H9O4P/c8-12(9,10)11-6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,8,9,10)

InChIKey:

YTFJQDNGSQJFNA-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	O[P](O)(=O)OCc1ccccc1
OpenEye OEToolkits 2.0.7	c1ccc(cc1)COP(=O)(O)O

Name:

(phenylmethyl) dihydrogen phosphate

ZINC:

ZINC000002391325

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).