BioLiP

PDB

BioLiP

PDB CCD ID:

DOD

Number of entries in BioLiP:

Chemical formula:

D2 O

InChI:

InChI=1S/H2O/h1H2/i/hD2

InChIKey:

XLYOFNOQVPJJNP-ZSJDYOACSA-N

SMILES:

Software	SMILES
CACTVS 3.370	O([2H])[2H]
ACDLabs 12.01 OpenEye OEToolkits 1.7.2	[2H]O[2H]

Name:

DEUTERATED WATER

ChEMBL:

CHEMBL1232306

Reference:

Chengxin Zhang, Xi Zhang, Lydia 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).