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BioLiP

PDB CCD ID: TN6
Number of entries in BioLiP: 1
Chemical formula: C4 H12 N O3 P
InChI: InChI=1S/C4H12NO3P/c1-3-5(4-2)9(6,7)8/h3-4H2,1-2H3,(H2,6,7,8)
InChIKey: NBAUUSKPFGFBQZ-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=P(O)(O)N(CC)CC
OpenEye OEToolkits 1.6.1CCN(CC)P(=O)(O)O
CACTVS 3.352CCN(CC)[P](O)(O)=O
Name:diethylphosphoramidic acid
ZINC: ZINC000058633663
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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