BioLiP

PDB

BioLiP

PDB CCD ID:

AAL

Number of entries in BioLiP:

Chemical formula:

C6 H10 O5

InChI:

InChI=1S/C6H10O5/c7-3-2-1-10-5(3)4(8)6(9)11-2/h2-9H,1H2/t2-,3+,4-,5+,6+/m0/s1

InChIKey:

DCQFFOLNJVGHLW-DSOBHZJASA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.7.0	C1[C@H]2[C@H]([C@@H](O1)[C@@H]([C@@H](O2)O)O)O
ACDLabs 11.02	OC2OC1C(O)C(OC1)C2O
OpenEye OEToolkits 1.7.0	C1C2C(C(O1)C(C(O2)O)O)O
CACTVS 3.352	O[CH]1O[CH]2CO[CH]([CH]1O)[CH]2O
CACTVS 3.352	O[C@@H]1O[C@H]2CO[C@@H]([C@@H]1O)[C@@H]2O

Name:

3,6-anhydro-alpha-L-galactopyranose;
3,6-ANHYDRO-L-GALACTOSE;
3,6-anhydro-alpha-L-galactose;
3,6-anhydro-galactose

ZINC:

ZINC000005851684

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).