SEQ2FUN

BioLiP

PDB CCD ID: ZLD
Number of entries in BioLiP: 1
Chemical formula: C16 H20 F N3 O4
InChI: InChI=1S/C16H20FN3O4/c1-11(21)18-9-13-10-20(16(22)24-13)12-2-3-15(14(17)8-12)19-4-6-23-7-5-19/h2-3,8,13H,4-7,9-10H2,1H3,(H,18,21)/t13-/m0/s1
InChIKey: TYZROVQLWOKYKF-ZDUSSCGKSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0CC(=O)NC[C@H]1CN(C(=O)O1)c2ccc(c(c2)F)N3CCOCC3
CACTVS 3.341CC(=O)NC[C@H]1CN(C(=O)O1)c2ccc(N3CCOCC3)c(F)c2
ACDLabs 10.04O=C1OC(CNC(=O)C)CN1c3cc(F)c(N2CCOCC2)cc3
OpenEye OEToolkits 1.5.0CC(=O)NCC1CN(C(=O)O1)c2ccc(c(c2)F)N3CCOCC3
CACTVS 3.341CC(=O)NC[CH]1CN(C(=O)O1)c2ccc(N3CCOCC3)c(F)c2
Name:N-{[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide;
Linezolid
ChEMBL: CHEMBL126
DrugBank: DB00601
ZINC: ZINC000002008866

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).