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BioLiP

PDB CCD ID: UGC
Number of entries in BioLiP: 4
Chemical formula: C3 H6 N2 O4
InChI: InChI=1S/C3H6N2O4/c4-3(9)5-1(6)2(7)8/h1,6H,(H,7,8)(H3,4,5,9)/t1-/m0/s1
InChIKey: NWZYYCVIOKVTII-SFOWXEAESA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01O=C(O)C(O)NC(=O)N
CACTVS 3.385NC(=O)N[C@@H](O)C(O)=O
OpenEye OEToolkits 1.7.6C(C(=O)O)(NC(=O)N)O
OpenEye OEToolkits 1.7.6[C@H](C(=O)O)(NC(=O)N)O
CACTVS 3.385NC(=O)N[CH](O)C(O)=O
Name:(2S)-(carbamoylamino)(hydroxy)ethanoic acid;
(S)-Ureidoglycolate
ZINC: ZINC000094437740
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).
  • 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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