BioLiP

PDB

BioLiP

PDB CCD ID:

SD4

Number of entries in BioLiP:

Chemical formula:

C4 H8 N2 O4

InChI:

InChI=1S/C4H8N2O4/c5-2(4(8)9)1-3(7)6-10/h2,10H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1

InChIKey:

ZBYVTTSIVDYQSO-REOHCLBHSA-N

SMILES:

Software	SMILES
CACTVS 3.370	N[CH](CC(=O)NO)C(O)=O
CACTVS 3.370	N[C@@H](CC(=O)NO)C(O)=O
OpenEye OEToolkits 1.7.6	C(C(C(=O)O)N)C(=O)NO
OpenEye OEToolkits 1.7.6	C([C@@H](C(=O)O)N)C(=O)NO

Name:

N-hydroxy-L-asparagine

ChEMBL:

CHEMBL63902

ZINC:

ZINC000002545150

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).