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BioLiP

PDB CCD ID: DOD
Number of entries in BioLiP: 0
Chemical formula: D2 O
InChI: InChI=1S/H2O/h1H2/i/hD2
InChIKey: XLYOFNOQVPJJNP-ZSJDYOACSA-N
SMILES:
SoftwareSMILES
CACTVS 3.370O([2H])[2H]
ACDLabs 12.01
OpenEye OEToolkits 1.7.2		[2H]O[2H]
Name:DEUTERATED WATER
ChEMBL: CHEMBL1232306
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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