BioLiP

PDB

BioLiP

PDB CCD ID:

TTN

Number of entries in BioLiP:

Chemical formula:

C3 H2 O5

InChI:

InChI=1S/C3H4O5/c4-1(2(5)6)3(7)8/h1,4H,(H,5,6)(H,7,8)/p-2

InChIKey:

ROBFUDYVXSDBQM-UHFFFAOYSA-L

SMILES:

Software	SMILES
CACTVS 3.341	OC(C([O-])=O)C([O-])=O
ACDLabs 10.04	[O-]C(=O)C(O)C([O-])=O
OpenEye OEToolkits 1.5.0	C(C(=O)[O-])(C(=O)[O-])O

Name:

TARTRONATE

DrugBank:

DB03680

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).