BioLiP

PDB

BioLiP

PDB CCD ID:

DGM

Number of entries in BioLiP:

Chemical formula:

C6 H11 O5

InChI:

InChI=1/C6H11O5/c7-1-4-6(10)5(9)3(8)2-11-4/h2-10H,1H2/q+1/t3-,4+,5+,6+/m0/s1

InChIKey:

UENHGZXMWVWJGF-SLPGGIOYBF

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	[CH+]1C(C(C(C(O1)CO)O)O)O
CACTVS 3.341	OC[CH]1O[CH+][CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.5.0	[CH+]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
ACDLabs 10.04	OC1C(O)C(O)[CH+]OC1CO
CACTVS 3.341	OC[C@H]1O[CH+][C@H](O)[C@@H](O)[C@@H]1O

Name:

D-GLUCOPYRANOSYLIUM

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).