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BioLiP

PDB CCD ID: 1GN
Number of entries in BioLiP: 11
Chemical formula: C6 H13 N O5
InChI: InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6-/m1/s1
InChIKey: MSWZFWKMSRAUBD-VFUOTHLCSA-N
SMILES:
SoftwareSMILES
CACTVS 3.341N[C@H]1[C@H](O)O[C@H](CO)[C@H](O)[C@@H]1O
CACTVS 3.341N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)N)O)O)O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O)N)O)O)O
ACDLabs 10.04OC1C(O)C(OC(O)C1N)CO
Name:2-amino-2-deoxy-beta-D-galactopyranose;
beta-D-galactosamine;
2-amino-2-deoxy-beta-D-galactose;
2-amino-2-deoxy-D-galactose;
2-amino-2-deoxy-galactose;
2-DEOXY-2-AMINOGALACTOSE
DrugBank: DB02678
ZINC: ZINC000003861073
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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