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BioLiP

PDB CCD ID: TCX
Number of entries in BioLiP: 2
Chemical formula: C2 H8 N O3 P
InChI: InChI=1S/C2H8NO3P/c1-2-3-7(4,5)6/h2H2,1H3,(H3,3,4,5,6)
InChIKey: CHKLMRVHXLBIHM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
ACDLabs 10.04O=P(O)(O)NCC
OpenEye OEToolkits 1.6.1CCNP(=O)(O)O
CACTVS 3.352CCN[P](O)(O)=O
Name:ethylphosphoramidic acid
ChEMBL: CHEMBL38354
ZINC: ZINC000029334790
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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