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BioLiP

PDB CCD ID: 5HY
Number of entries in BioLiP: 2
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:
SoftwareSMILES
CACTVS 3.370OC(=O)C[CH]1NC(=O)NC1=O
CACTVS 3.370OC(=O)C[C@H]1NC(=O)NC1=O
ACDLabs 12.01O=C1NC(=O)NC1CC(=O)O
OpenEye OEToolkits 1.7.0C([C@@H]1C(=O)NC(=O)N1)C(=O)O
OpenEye OEToolkits 1.7.0C(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, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • 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).

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