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BioLiP

PDB CCD ID: A1H3M
Number of entries in BioLiP: 1
Chemical formula: C7 H11 N3 O2
InChI: InChI=1S/C7H11N3O2/c8-5-1-2-6(7(9)12)10(3-5)4-11/h4,6,8H,1-3H2,(H2,9,12)/b8-5+/t6-/m0/s1
InChIKey: SVUBAXFAVRYYJU-YTDSJMIDSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385NC(=O)[CH]1CCC(=N)CN1C=O
CACTVS 3.385NC(=O)[C@@H]1CCC(=N)CN1C=O
OpenEye OEToolkits 2.0.7C1CC(=N)CN(C1C(=O)N)C=O
OpenEye OEToolkits 2.0.7[H]/N=C/1\CC[C@H](N(C1)C=O)C(=O)N
Name:(2~{S})-5-azanylidene-1-methanoyl-piperidine-2-carboxamide;
Avibactam
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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