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BioLiP Library

PDB CCD ID: EI4
Number of entries in BioLiP: 0
Chemical formula: C6 H12 N4 O2
InChI: InChI=1S/C6H12N4O2/c7-4(5(11)12)1-3-2-9-6(8)10-3/h3-4H,1-2,7H2,(H,11,12)(H3,8,9,10)/t3-,4-/m0/s1
InChIKey: VFXRPXBQCNHQRQ-IMJSIDKUSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7C1C(NC(=N)N1)CC(C(=O)O)N
CACTVS 3.385N[C@@H](C[C@H]1CNC(=N)N1)C(O)=O
CACTVS 3.385N[CH](C[CH]1CNC(=N)N1)C(O)=O
OpenEye OEToolkits 2.0.7[H]/N=C\1/NC[C@@H](N1)C[C@@H](C(=O)O)N
Name:Enduracididine
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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