BioLiP

PDB

BioLiP

PDB CCD ID:

7PR

Number of entries in BioLiP:

Chemical formula:

C6 H9 O6 Pr

InChI:

InChI=1S/3C2H4O2.Pr/c3*1-2(3)4;/h3*1H3,(H,3,4);/q;;;+3/p-3

InChIKey:

KPXRPRLCONABEG-UHFFFAOYSA-K

SMILES:

Software	SMILES
CACTVS 3.385	CC(=O)O[Pr](OC(C)=O)OC(C)=O
OpenEye OEToolkits 2.0.6	CC(=O)O[Pr](OC(=O)C)OC(=O)C
ACDLabs 12.01	C(=O)(C)O[Pr](OC(C)=O)OC(=O)C

Name:

praseodymium triacetate

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).