SEQ2FUN

BioLiP

PDB CCD ID: 0OY
Number of entries in BioLiP: 1
Chemical formula: C11 H13 N O3
InChI: InChI=1S/C11H13NO3/c13-10-3-1-9(2-4-10)11(14)12-5-7-15-8-6-12/h1-4,13H,5-8H2
InChIKey: GJHYHTYGGHFYNN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6c1cc(ccc1C(=O)N2CCOCC2)O
ACDLabs 12.01O=C(c1ccc(O)cc1)N2CCOCC2
CACTVS 3.370Oc1ccc(cc1)C(=O)N2CCOCC2
Name:(4-hydroxyphenyl)(morpholin-4-yl)methanone
ZINC: ZINC000005252719
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).