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BioLiP

PDB CCD ID: AXO
Number of entries in BioLiP: 1
Chemical formula: C2 H5 N O
InChI: InChI=1S/C2H5NO/c1-2-3-4/h2,4H,1H3/b3-2+
InChIKey: FZENGILVLUJGJX-NSCUHMNNSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385
OpenEye OEToolkits 1.7.6		C/C=N/O
CACTVS 3.385
OpenEye OEToolkits 1.7.6		CC=NO
ACDLabs 12.01N(/O)=C\C
Name:(1E)-N-hydroxyethanimine;
Acetaldoxime
ZINC: ZINC000100006104
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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