BioLiP

PDB

BioLiP

PDB CCD ID:

5HY

Number of entries in BioLiP:

Chemical formula:

C5 H6 N2 O4

InChI:

InChI=1S/C5H6N2O4/c8-3(9)1-2-4(10)7-5(11)6-2/h2H,1H2,(H,8,9)(H2,6,7,10,11)/t2-/m1/s1

InChIKey:

DQQLZADYSWBCOX-UWTATZPHSA-N

SMILES:

Software	SMILES
CACTVS 3.370	OC(=O)C[CH]1NC(=O)NC1=O
CACTVS 3.370	OC(=O)C[C@H]1NC(=O)NC1=O
ACDLabs 12.01	O=C1NC(=O)NC1CC(=O)O
OpenEye OEToolkits 1.7.0	C([C@@H]1C(=O)NC(=O)N1)C(=O)O
OpenEye OEToolkits 1.7.0	C(C1C(=O)NC(=O)N1)C(=O)O

Name:

[(4R)-2,5-dioxoimidazolidin-4-yl]acetic acid;
Hydantoin-5-acetic acid

ZINC:

ZINC000000901817

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).