BioLiP

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●BioLiP ●E. coli ●GLASS ●GPCR-HGmod ●GPCR-RD ●GPCR-EXP ●Tara-3D ●TM-fold ●DECOYS ●POTENTIAL ●RW/RWplus ●EvoEF ●HPSF ●THE-DB ●ADDRESS ●Alpaca-Antibody ●CASP7 ●CASP8 ●CASP9 ●CASP10 ●CASP11 ●CASP12 ●CASP13 ●CASP14

BioLiP

PDB

BioLiP

PDB CCD ID:

NGZ

Number of entries in BioLiP:

Chemical formula:

C8 H15 N O6

InChI:

InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6-,7-,8+/m0/s1

InChIKey:

OVRNDRQMDRJTHS-DMHSOCPYSA-N

SMILES:

Software	SMILES
CACTVS 3.385	CC(=O)N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O
CACTVS 3.385	CC(=O)N[C@@H]1[C@H](O)O[C@@H](CO)[C@H](O)[C@H]1O
ACDLabs 12.01	C1(C(C(C(C(CO)O1)O)O)NC(C)=O)O
OpenEye OEToolkits 1.7.6	CC(=O)N[C@H]1[C@@H]([C@H]([C@@H](O[C@H]1O)CO)O)O
OpenEye OEToolkits 1.7.6	CC(=O)NC1C(C(C(OC1O)CO)O)O

Name:

2-acetamido-2-deoxy-alpha-L-glucopyranose;
N-acetyl-alpha-L-glucosamine;
2-acetamido-2-deoxy-alpha-L-glucose;
2-acetamido-2-deoxy-L-glucose;
2-acetamido-2-deoxy-glucose;
2-(ACETYLAMINO)-2-DEOXY-ALPHA-L-GLUCOPYRANOSE

Reference:

Chengxin Zhang, Xi Zhang, Peter L 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).

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