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BioLiP Library

PDB CCD ID: AZW
Number of entries in BioLiP: 0
Chemical formula: C14 H15 N2 O5 P
InChI: InChI=1S/C14H15N2O5P/c17-9-11-1-5-13(6-2-11)15-16-14-7-3-12(4-8-14)10-21-22(18,19)20/h1-8,17H,9-10H2,(H2,18,19,20)/b16-15+
InChIKey: VKJQDDQQGBKCEZ-FOCLMDBBSA-N
SMILES:
SoftwareSMILES
ACDLabs 12.01P(O)(OCc1ccc(cc1)\N=N\c2ccc(cc2)CO)(O)=O
OpenEye OEToolkits 1.7.6c1cc(ccc1CO)/N=N/c2ccc(cc2)COP(=O)(O)O
CACTVS 3.385OCc1ccc(cc1)N=Nc2ccc(CO[P](O)(O)=O)cc2
OpenEye OEToolkits 1.7.6c1cc(ccc1CO)N=Nc2ccc(cc2)COP(=O)(O)O
Name:4-{(E)-[4-(hydroxymethyl)phenyl]diazenyl}benzyl dihydrogen phosphate
ZINC: ZINC000263621126
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)(download the PDF file).
  • 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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