BioLiP

PDB

BioLiP

PDB CCD ID:

X8X

Number of entries in BioLiP:

Chemical formula:

C6 H10 O6

InChI:

InChI=1S/C6H10O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-5,7-10H,1H2/t2-,3-,4-,5+/m0/s1

InChIKey:

SXZYCXMUPBBULW-NEEWWZBLSA-N

SMILES:

Software	SMILES
CACTVS 3.385	OC[C@H](O)[C@H]1OC(=O)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 2.0.7	C([C@@H]([C@@H]1[C@H]([C@@H](C(=O)O1)O)O)O)O
CACTVS 3.385	OC[CH](O)[CH]1OC(=O)[CH](O)[CH]1O
OpenEye OEToolkits 2.0.7	C(C(C1C(C(C(=O)O1)O)O)O)O

Name:

L-galactono-1,4-lactone;
(3S,4S,5R)-5-[(1S)-1,2-bis(oxidanyl)ethyl]-3,4-bis(oxidanyl)oxolan-2-one;
gamma-L-galactonolactone

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).