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BioLiP Library

PDB CCD ID: AXM
Number of entries in BioLiP: 2
Chemical formula: C12 H19 N O2
InChI: InChI=1S/C12H19NO2/c14-11(13-15)7-12-4-8-1-9(5-12)3-10(2-8)6-12/h8-10,15H,1-7H2,(H,13,14)/t8-,9+,10-,12-
InChIKey: JKZCKUGJZBWOQO-GOCCLTDMSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01O=C(NO)CC13CC2CC(CC(C1)C2)C3
CACTVS 3.370ONC(=O)CC12CC3CC(CC(C3)C1)C2
OpenEye OEToolkits 1.7.6C1C2CC3CC1CC(C2)(C3)CC(=O)NO
Name:N-hydroxy-2-[(3S,5S,7S)-tricyclo[3.3.1.1~3,7~]dec-1-yl]acetamide;
Adamantane acetic acid hydroxamate
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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