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BioLiP

PDB CCD ID: YMC
Number of entries in BioLiP: 2
Chemical formula: C19 H14 N2 O3
InChI: InChI=1S/C19H14N2O3/c22-15-4-1-3-13(11-15)12-7-9-14(10-8-12)20-16-5-2-6-17-18(16)19(23)21-24-17/h1-11,20,22H,(H,21,23)
InChIKey: YQJXZEDYPMNSBG-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(cc(c1)O)c2ccc(cc2)Nc3cccc4c3c(no4)O
CACTVS 3.385Oc1cccc(c1)c2ccc(Nc3cccc4onc(O)c34)cc2
Name:4-[[4-(3-hydroxyphenyl)phenyl]amino]-1,2-benzoxazol-3-ol;
4-[(3'-hydroxy[1,1'-biphenyl]-4-yl)amino]-1,2-benzoxazol-3-ol
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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