BioLiP

PDB

BioLiP

PDB CCD ID:

GPJ

Number of entries in BioLiP:

Chemical formula:

C3 H9 N O5 P

InChI:

InChI=1S/C3H8NO5P/c5-3(6)1-4-2-10(7,8)9/h4H,1-2H2,(H,5,6)(H2,7,8,9)/p+1

InChIKey:

XDDAORKBJWWYJS-UHFFFAOYSA-O

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C(C(=O)O)[NH2+]CP(=O)(O)O
CACTVS 3.341	OC(=O)C[NH2+]C[P](O)(O)=O
ACDLabs 10.04	O=C(O)C[NH2+]CP(=O)(O)O

Name:

GLYPHOSATE

DrugBank:

DB04539

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).