BioLiP

PDB

BioLiP

PDB CCD ID:

DPL

Number of entries in BioLiP:

Chemical formula:

C5 H7 N O3

InChI:

InChI=1S/C5H7NO3/c7-3-1-4(5(8)9)6-2-3/h4,6H,1-2H2,(H,8,9)/t4-/m0/s1

InChIKey:

HFXAFXVXPMUQCQ-BYPYZUCNSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C1[C@H](NCC1=O)C(=O)O
CACTVS 3.341	OC(=O)[CH]1CC(=O)CN1
ACDLabs 10.04	O=C(O)C1NCC(=O)C1
OpenEye OEToolkits 1.5.0	C1C(NCC1=O)C(=O)O
CACTVS 3.341	OC(=O)[C@@H]1CC(=O)CN1

Name:

4-OXOPROLINE

ZINC:

ZINC000000901173

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).