BioLiP

PDB

BioLiP

PDB CCD ID:

GCN

Number of entries in BioLiP:

Chemical formula:

C6 H13 N O4

InChI:

InChI=1S/C6H13NO4/c7-3-1-4(9)5(2-8)11-6(3)10/h3-6,8-10H,1-2,7H2/t3-,4+,5-,6+/m1/s1

InChIKey:

SNDZDGQLFKEBLF-MOJAZDJTSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	C1[C@H]([C@H](O[C@@H]([C@H]1O)CO)O)N
CACTVS 3.341	N[CH]1C[CH](O)[CH](CO)O[CH]1O
CACTVS 3.341	N[C@@H]1C[C@H](O)[C@@H](CO)O[C@@H]1O
OpenEye OEToolkits 1.5.0	C1C(C(OC(C1O)CO)O)N
ACDLabs 10.04	OC1C(OC(O)C(N)C1)CO

Name:

2-amino-2,3-dideoxy-alpha-D-glucoyranose;
3-DEOXY-D-GLUCOSAMINE;
3-deoxy-alpha-D-glucosamine

DrugBank:

DB02700

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).