BioLiP

PDB

BioLiP

PDB CCD ID:

CDR

Number of entries in BioLiP:

Chemical formula:

C6 H12 O3

InChI:

InChI=1S/C6H12O3/c1-4-5(7)2-3-6(8)9-4/h4-8H,2-3H2,1H3/t4-,5+,6-/m1/s1

InChIKey:

ZCYMCBOUZXAAJG-NGJCXOISSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.7.6	C[C@@H]1[C@H](CC[C@@H](O1)O)O
ACDLabs 12.01	OC1C(OC(O)CC1)C
OpenEye OEToolkits 1.7.6	CC1C(CCC(O1)O)O
CACTVS 3.385	C[CH]1O[CH](O)CC[CH]1O
CACTVS 3.385	C[C@H]1O[C@@H](O)CC[C@@H]1O

Name:

(2R,5S,6R)-6-methyltetrahydro-2H-pyran-2,5-diol;
2,3-DIDEOXYFUCOSE

DrugBank:

DB03872

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).