BioLiP

PDB

BioLiP

PDB CCD ID:

D3O

Number of entries in BioLiP:

Chemical formula:

D3 O

InChI:

InChI=1S/H2O/h1H2/p+1/i/hD3

InChIKey:

XLYOFNOQVPJJNP-ZRLBSURWSA-O

SMILES:

Software	SMILES
ACDLabs 12.01 OpenEye OEToolkits 1.9.2	[2H][O+]([2H])[2H]
CACTVS 3.385	[O+]([2H])([2H])[2H]

Name:

trideuteriooxidanium;
perdeuterated oxonium

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).