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BioLiP

PDB CCD ID: OKS
Number of entries in BioLiP: 2
Chemical formula: C8 H18 N2 O2
InChI: InChI=1S/C8H18N2O2/c9-7-5-3-1-2-4-6-8(11)10-12/h12H,1-7,9H2,(H,10,11)
InChIKey: GPJAXDUQXFPTEI-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01C(CCCCCCC(=O)NO)N
OpenEye OEToolkits 2.0.7C(CCCC(=O)NO)CCCN
CACTVS 3.385NCCCCCCCC(=O)NO
Name:8-amino-N-hydroxyoctanamide
ZINC: ZINC000141111346
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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