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BioLiP

PDB CCD ID: PND
Number of entries in BioLiP: 2
Chemical formula: C6 H7 N3 O2
InChI: InChI=1S/C6H7N3O2/c7-8-5-1-3-6(4-2-5)9(10)11/h1-4,8H,7H2
InChIKey: KMVPXBDOWDXXEN-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.5.0c1cc(ccc1NN)[N+](=O)[O-]
CACTVS 3.341NNc1ccc(cc1)[N+]([O-])=O
ACDLabs 10.04[O-][N+](=O)c1ccc(NN)cc1
Name:P-NITROPHENYLHYDRAZINE
ZINC: ZINC000003860923
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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