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BioLiP

PDB CCD ID: E9H
Number of entries in BioLiP: 10
Chemical formula: C16 H35 O4 P
InChI: InChI=1S/C16H35O4P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-21(17,18)19/h2-16H2,1H3,(H2,17,18,19)
InChIKey: ZUVCYFMOHFTGDM-UHFFFAOYSA-N
SMILES:
SoftwareSMILES
OpenEye OEToolkits 2.0.6CCCCCCCCCCCCCCCCOP(=O)(O)O
CACTVS 3.385CCCCCCCCCCCCCCCCO[P](O)(O)=O
Name:hexadecyl dihydrogen phosphate
ChEMBL: CHEMBL479322
ZINC: ZINC000044431734
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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