SEQ2FUN

BioLiP

PDB CCD ID: P93
Number of entries in BioLiP: 1
Chemical formula: C10 H14 N2 O2
InChI: InChI=1S/C10H14N2O2/c13-10(12-4-1-2-5-12)11-7-9-3-6-14-8-9/h3,6,8H,1-2,4-5,7H2,(H,11,13)
InChIKey: ONGBBTQZWYAQQB-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
CACTVS 3.385O=C(NCc1cocc1)N2CCCC2
ACDLabs 12.01O=C(N1CCCC1)NCc2cocc2
OpenEye OEToolkits 2.0.4c1cocc1CNC(=O)N2CCCC2
Name:N-[(furan-3-yl)methyl]pyrrolidine-1-carboxamide
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).