BioLiP

PDB

BioLiP

PDB CCD ID:

G8X

Number of entries in BioLiP:

Chemical formula:

C5 H9 N O3

InChI:

InChI=1S/C5H9NO3/c7-3-1-2-6-4(3)5(8)9/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/m1/s1

InChIKey:

BJBUEDPLEOHJGE-DMTCNVIQSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C1CNC(C1O)C(=O)O
CACTVS 3.385	O[CH]1CCN[CH]1C(O)=O
OpenEye OEToolkits 2.0.7	C1CN[C@@H]([C@@H]1O)C(=O)O
CACTVS 3.385	O[C@@H]1CCN[C@@H]1C(O)=O

Name:

(2~{S},3~{R})-3-oxidanylpyrrolidine-2-carboxylic acid

ZINC:

ZINC000004521590

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).