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BioLiP Library

PDB CCD ID: VWO
Number of entries in BioLiP: 1
Chemical formula: C10 H9 N O4 S
InChI: InChI=1S/C10H9NO4S/c11-7-2-1-6-3-8(16(13,14)15)5-10(12)9(6)4-7/h1-5,12H,11H2,(H,13,14,15)
InChIKey: HBZVNWNSRNTWPS-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc(cc2c1cc(cc2O)S(=O)(=O)O)N
CACTVS 3.385Nc1ccc2cc(cc(O)c2c1)[S](O)(=O)=O
Name:6-azanyl-4-oxidanyl-naphthalene-2-sulfonic acid;
7-amino-1-naphthol-3-sulfonic acid

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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