SEQ2FUN

BioLiP

PDB CCD ID: F9P
Number of entries in BioLiP: 2
Chemical formula: C7 H13 N O2
InChI: InChI=1S/C7H13NO2/c9-7(8-10)6-4-2-1-3-5-6/h6,10H,1-5H2,(H,8,9)
InChIKey: RFWDAWXPYZTVSN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385ONC(=O)C1CCCCC1
OpenEye OEToolkits 2.0.6C1CCC(CC1)C(=O)NO
ACDLabs 12.01C1CCCCC1C(NO)=O
Name:N-hydroxycyclohexanecarboxamide;
cyclohexylhydroxamate
ChEMBL: CHEMBL2333345
ZINC: ZINC000006415504
Reference:
  • Chengxin Zhang, Xi Zhang, Lydia 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).