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BioLiP

PDB CCD ID: SLS
Number of entries in BioLiP: 1
Chemical formula: C10 H11 N O2
InChI: InChI=1S/C10H11NO2/c11-10(12)8-3-4-9-7(6-8)2-1-5-13-9/h3-4,6H,1-2,5H2,(H2,11,12)
InChIKey: HJLYHXATZHROAL-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6c1cc2c(cc1C(=O)N)CCCO2
CACTVS 3.385NC(=O)c1ccc2OCCCc2c1
Name:3,4-dihydro-2~{H}-chromene-6-carboxamide
ZINC: ZINC000039470953
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).
  • 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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