BioLiP

PDB

BioLiP

PDB CCD ID:

LXQ

Number of entries in BioLiP:

Chemical formula:

C7 H11 N O3

InChI:

InChI=1S/C7H11NO3/c1-5(9)8-3-2-6(4-8)7(10)11/h6H,2-4H2,1H3,(H,10,11)/t6-/m1/s1

InChIKey:

FEQQMBBBBFVNMN-ZCFIWIBFSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	CC(=O)N1CCC(C1)C(=O)O
CACTVS 3.385	CC(=O)N1CC[CH](C1)C(O)=O
OpenEye OEToolkits 2.0.7	CC(=O)N1CC[C@H](C1)C(=O)O
CACTVS 3.385	CC(=O)N1CC[C@H](C1)C(O)=O

Name:

(3~{R})-1-ethanoylpyrrolidine-3-carboxylic acid

ZINC:

ZINC000019686084

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).