BioLiP

PDB

BioLiP

PDB CCD ID:

KFG

Number of entries in BioLiP:

Chemical formula:

C2 H7 O4 P

InChI:

InChI=1S/C2H7O4P/c1-5-7(3,4)6-2/h1-2H3,(H,3,4)

InChIKey:

KKUKTXOBAWVSHC-UHFFFAOYSA-N

SMILES:

Software	SMILES
ACDLabs 12.01 OpenEye OEToolkits 2.0.6	COP(=O)(O)OC
CACTVS 3.385	CO[P](O)(=O)OC

Name:

dimethyl hydrogen phosphate

ZINC:

ZINC000003957811

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).