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BioLiP

PDB CCD ID: QMP
Number of entries in BioLiP: 4
Chemical formula: C7 H15 O3 P
InChI: InChI=1S/C7H15O3P/c1-11(8,9)10-7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H,8,9)
InChIKey: SWYGLBJVTQMYSE-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 1.7.6CP(=O)(O)OC1CCCCC1
ACDLabs 12.01O=P(O)(OC1CCCCC1)C
CACTVS 3.370C[P](O)(=O)OC1CCCCC1
Name:cyclohexyl methylphosphonate
ZINC: ZINC000006068355
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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