BioLiP

PDB

BioLiP

PDB CCD ID:

N8P

Number of entries in BioLiP:

Chemical formula:

C7 H11 N O3

InChI:

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

InChIKey:

GNMSLDIYJOSUSW-ZCFIWIBFSA-N

SMILES:

Software	SMILES
CACTVS 3.385	CC(=O)N1CCC[CH]1C(O)=O
ACDLabs 12.01	O=C(N1C(C(=O)O)CCC1)C
OpenEye OEToolkits 1.9.2	CC(=O)N1CCC[C@@H]1C(=O)O
CACTVS 3.385	CC(=O)N1CCC[C@@H]1C(O)=O
OpenEye OEToolkits 1.9.2	CC(=O)N1CCCC1C(=O)O

Name:

N-ACETYL-D-PROLINE

ChEMBL:

CHEMBL3137742

ZINC:

ZINC000000119667

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).