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BioLiP

PDB CCD ID: H7N
Number of entries in BioLiP: 6
Chemical formula: C10 H23 O3 P
InChI: InChI=1S/C10H23O3P/c1-3-5-7-8-10-14(11,12)13-9-6-4-2/h3-10H2,1-2H3,(H,11,12)
InChIKey: ALZDUSNEVXETKK-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6CCCCCC[P@@](=O)(O)OCCCC
OpenEye OEToolkits 2.0.6CCCCCCP(=O)(O)OCCCC
CACTVS 3.385CCCCCC[P](O)(=O)OCCCC
Name:butoxy(hexyl)phosphinic 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).
  • 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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