{ "glytoucan_ac": "G00056MO", "number_monosaccharides": 2, "mass": 383.14, "mass_pme": 495.27, "fully_determined": "yes", "iupac": "beta-D-Galp-(1->3)-beta-D-GlcpNAc-(1->", "wurcs": "WURCS=2.0/2,2,1/[a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2/a3-b1", "glycoct": "RES 1b:b-dglc-HEX-1:5 2s:n-acetyl 3b:b-dgal-HEX-1:5 LIN 1:1d(2+1)2n 2:1o(3+1)3d", "inchi": "InChI=1S/C14H25NO11/c1-4(18)15-7-12(9(20)6(3-17)24-13(7)23)26-14-11(22)10(21)8(19)5(2-16)25-14/h5-14,16-17,19-23H,2-3H2,1H3,(H,15,18)/t5-,6-,7-,8+,9-,10+,11-,12-,13-,14+/m1/s1", "glycam": "DGalpb1-3DGlcpNAcb1-OH", "smiles_isomeric": "CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O)CO)O)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O", "inchi_key": { "key": "HMQPEDMEOBLSQB-LODBTCKLSA-N", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/HMQPEDMEOBLSQB-LODBTCKLSA-N" }, "crossref": [ { "id": "G00056MO", "database": "GlyTouCan", "url": "https://glytoucan.org/Structures/Glycans/G00056MO", "categories": [ "Glycomics" ] }, { "id": "GSD000181", "url": "https://wiki.glygen.org/Glycan_structure_dictionary#GSD000181", "database": "Glycan Structure Dictionary", "categories": [ "Ontology and Dictionary" ] } ], "publication": [ { "title": "Purification of anti-Lec antibodies with specificity for beta DGal(1 replaced by 3)beta DGlcNAcO- using a synthetic immunoadsorbent.", "journal": "Vox sanguinis", "date": "1982", "authors": "Le Pendu J, Lemieux RU, Oriol R", "evidence": [ { "database": "Glycan Motif", "id": "GGM.000005", "url": "https://glycomotif.glyomics.org/glycomotif/GGM.000005" } ], "reference": [ { "type": "PubMed", "id": "6182692", "url": "https://glygen.org/publication/PubMed/6182692" } ] }, { "title": "The repertoire of glycan determinants in the human glycome.", "journal": "Molecular bioSystems", "date": "2009", "authors": "Cummings RD", "evidence": [ { "database": "Glycan Motif", "id": "GGM.000005", "url": "https://glycomotif.glyomics.org/glycomotif/GGM.000005" } ], "reference": [ { "type": "PubMed", "id": "19756298", "url": "https://glygen.org/publication/PubMed/19756298" } ] } ], "residues": [], "composition": [ { "name": "6-Deoxy-Hexose", "residue": "dhex", "count": 0, "cid": "840", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/840" }, { "name": "Hexose", "residue": "hex", "count": 1, "cid": "206", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/206" }, { "name": "N-Acetylhexosamine", "residue": "hexnac", "count": 1, "cid": "899", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/899" }, { "name": "Hexuronic Acid", "residue": "hexa", "count": 0, "cid": "610", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/610" }, { "name": "2-Amino-2-Deoxy-Hexose", "residue": "hexn", "count": 0, "cid": "739", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/739" }, { "name": "N-Acetyl-Neuraminic Acid", "residue": "neuac", "count": 0, "cid": "439197", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/439197" }, { "name": "N-Glycolyl-Neuraminic Acid", "residue": "neugc", "count": 0, "cid": "440001", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/440001" }, { "name": "Phosphate", "residue": "p", "count": 0, "cid": "1061", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/1061" }, { "name": "Pentose", "residue": "pent", "count": 0, "cid": "229", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/229" }, { "name": "Sulfate", "residue": "s", "count": 0, "cid": "1117", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/1117" }, { "name": "Other", "residue": "other", "count": 0 } ], "composition_expanded": [ { "name": "Alditol", "residue": "aldi", "count": 0 }, { "name": "6-Deoxy-Hexose", "residue": "dhex", "count": 0, "cid": "840", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/840" }, { "name": "6-Deoxy-Hexitol", "residue": "dhex+aldi", "count": 0 }, { "name": "L-Fucose", "residue": "fuc", "count": 0, "cid": "17106", "url": "https://pubchem.ncbi.nlm.nih.gov/compound/17106" }, { "name": "L-Fucitol", "residue": "fuc+aldi", "count": 0, "cid": "445724", "url": 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"LacNAc", "url": "https://glycomotif.glyomics.org/glycomotif/LacNAc" }, { "label": "N-acetyllactosamine", "url": "https://glycomotif.glyomics.org/glycomotif/N-acetyllactosamine" }, { "label": "N-acetyllactosamine type 1", "url": "https://glycomotif.glyomics.org/glycomotif/N-acetyllactosamine_type_1" } ], "reducing_end": "false", "aglycon": "R", "alignment_method": "Substructure", "dictionary": { "term": "N-acetyllactosamine (Type 1)", "term_in_sentence": "The N-acetyllactosamine type 1 (LacNAc type 1, Gal\u03b21,3GlcNAc) is a well-known precursor of several important blood group epitopes, such as Lewis A, Lewis B, or sialyl Lewis A [1], which are involved in many biological processes, e.g., fertilization [2] and pathogen adhesion [3]. 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