BioLiP

PDB

BioLiP

PDB CCD ID:

021

Number of entries in BioLiP:

Chemical formula:

C7 H13 N O2

InChI:

InChI=1S/C7H13NO2/c9-7(10)5-8-6-3-1-2-4-6/h6,8H,1-5H2,(H,9,10)

InChIKey:

LRHRHAWNXCGABU-UHFFFAOYSA-N

SMILES:

Software	SMILES
CACTVS 3.370	OC(=O)CNC1CCCC1
ACDLabs 12.01	O=C(O)CNC1CCCC1
OpenEye OEToolkits 1.7.0	C1CCC(C1)NCC(=O)O

Name:

N-cyclopentylglycine

ZINC:

ZINC000001759505

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).