{
    "glytoucan_ac": "G08431YY",
    "number_monosaccharides": 9,
    "number_monosaccharides_suffix": "",
    "mass": 1655.59,
    "mass_pme": 2062.05,
    "tool_support": {
        "gnome_glygen_oglycans": "no",
        "sandbox": "no",
        "gnome_glygen": "yes",
        "gnome": "yes",
        "gnome_glycotree_oglycans": "no",
        "pdb": "no",
        "gnome_glygen_nglycans": "no",
        "gnome_glycotree_nglycans": "no"
    },
    "fully_determined": "",
    "missing_score": 109,
    "glycan_type": "Saccharide",
    "iupac": "alpha-D-Neup5Ac-(2->3)-beta-D-Galp-(1->3)[alpha-L-Fucp-(1->4)]-beta-D-GlcpNAc-(1->3)[beta-D-Galp-(1->4)[alpha-L-Fucp-(1->3)]-beta-D-GlcpNAc-(1->6)]-beta-D-Galp-(1->4)-?-D-Glcp-(1->",
    "wurcs": "WURCS=2.0/5,9,8/[a2122h-1x_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][Aad21122h-2a_2-6_5*NCC/3=O][a1221m-1a_1-5]/1-2-3-2-4-5-3-5-2/a4-b1_b3-c1_b6-g1_c3-d1_c4-f1_d3-e2_g3-h1_g4-i1",
    "glycoct": "RES 1b:x-dglc-HEX-1:5 2b:b-dgal-HEX-1:5 3b:b-dglc-HEX-1:5 4s:n-acetyl 5b:b-dgal-HEX-1:5 6b:a-dgro-dgal-NON-2:6|1:a|2:keto|3:d 7s:n-acetyl 8b:a-lgal-HEX-1:5|6:d 9b:b-dglc-HEX-1:5 10s:n-acetyl 11b:a-lgal-HEX-1:5|6:d 12b:b-dgal-HEX-1:5 LIN 1:1o(4+1)2d 2:2o(3+1)3d 3:3d(2+1)4n 4:3o(3+1)5d 5:5o(3+2)6d 6:6d(5+1)7n 7:3o(4+1)8d 8:2o(6+1)9d 9:9d(2+1)10n 10:9o(3+1)11d 11:9o(4+1)12d",
    "inchi": "InChI=1S/C63H105N3O47/c1-14-30(78)36(84)41(89)57(98-14)107-48-25(12-72)104-56(29(66-18(5)75)51(48)110-61-45(93)53(34(82)22(9-69)102-61)113-63(62(95)96)6-19(76)27(64-16(3)73)49(112-63)32(80)20(77)7-67)111-52-35(83)26(105-60(44(52)92)106-46-23(10-70)100-54(94)40(88)39(46)87)13-97-55-28(65-17(4)74)50(109-58-42(90)37(85)31(79)15(2)99-58)47(24(11-71)103-55)108-59-43(91)38(86)33(81)21(8-68)101-59/h14-15,19-61,67-72,76-94H,6-13H2,1-5H3,(H,64,73)(H,65,74)(H,66,75)(H,95,96)/t14-,15-,19-,20+,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+,31+,32+,33-,34-,35-,36+,37+,38-,39+,40+,41-,42-,43+,44+,45+,46+,47+,48+,49+,50+,51+,52-,53-,54?,55+,56-,57-,58-,59-,60-,61-,63-/m0/s1",
    "glycam": "",
    "smiles_isomeric": "C[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O[C@@]4(C[C@@H]([C@H]([C@@H](O4)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)NC(=O)C)O[C@H]5[C@H]([C@H](O[C@H]([C@@H]5O)O[C@@H]6[C@H](OC([C@@H]([C@H]6O)O)O)CO)CO[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O[C@H]8[C@@H]([C@H]([C@H]([C@H](O8)CO)O)O)O)O[C@H]9[C@H]([C@@H]([C@@H]([C@@H](O9)C)O)O)O)NC(=O)C)O)CO)O)O)O",
    "inchi_key": {
        "key": "GKRLLPTWDWKEDC-ADEJEMNKSA-N",
        "url": "https://pubchem.ncbi.nlm.nih.gov/compound/GKRLLPTWDWKEDC-ADEJEMNKSA-N"
    },
    "byonic": "Hex(4)HexNAc(2)dHex(2)NeuAc(1) % 1655.59183828",
    "gwb": "freeEnd--1?1D-Glc,p--4b1D-Gal,p(--3b1D-GlcNAc,p(--3b1D-Gal,p--3a2D-NeuAc,p)--4a1L-Fuc,p)--6b1D-GlcNAc,p(--3a1L-Fuc,p)--4b1D-Gal,p$MONO,Und,0,0,freeEnd",
    "species": [
        {
            "taxid": 9606,
            "name": "Homo sapiens",
            "annotation_category": "Direct",
            "evidence": [
                {
                    "database": "GlyConnect",
                    "id": "933",
                    "url": "https://glyconnect.expasy.org/browser/structures/933"
                }
            ],
            "common_name": "Human"
        }
    ],
    "classification": [
        {
            "type": {
                "name": "Glycosphingolipid"
            },
            "subtype": {
                "name": "Lacto series"
            }
        }
    ],
    "enzyme": [],
    "crossref": [
        {
            "id": "71297272",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/71297272",
            "database": "PubChem Compound"
        },
        {
            "id": "252295082",
            "url": "https://pubchem.ncbi.nlm.nih.gov/substance/252295082",
            "database": "PubChem Substance"
        },
        {
            "id": "G04509",
            "url": "https://www.genome.jp/dbget-bin/www_bget?gl:G04509",
            "database": "KEGG Glycan"
        },
        {
            "id": "933",
            "url": "https://glyconnect.expasy.org/browser/structures/933",
            "database": "GlyConnect"
        },
        {
            "id": "146832",
            "url": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=146832",
            "database": "ChEBI"
        },
        {
            "id": "G08431YY",
            "url": "https://glytoucan.org/Structures/Glycans/G08431YY",
            "database": "GlyTouCan"
        },
        {
            "id": "G08431YY",
            "url": "https://gnome.glyomics.org/restrictions/GlyGen.StructureBrowser.html?focus=G08431YY",
            "database": "GNOme"
        },
        {
            "id": "G08431YY",
            "url": "https://glycosmos.org/glycans/show/G08431YY",
            "database": "GlyCosmos"
        }
    ],
    "glycoprotein": [],
    "publication": [
        {
            "title": "Three novel oligosaccharides with the sialyl-Lea structure in human milk: isolation by immunoaffinity chromatography.",
            "journal": "Biochemistry",
            "date": "1989",
            "authors": "Kitagawa H, Nakada H, Kurosaka A, Hiraiwa N, Numata Y, Fukui S, Funakoshi I, Kawasaki T, Yamashina I, Shimada I, et al.",
            "evidence": [
                {
                    "database": "GlyConnect",
                    "id": "933",
                    "url": "https://glyconnect.expasy.org/browser/structures/933"
                }
            ],
            "reference": [
                {
                    "type": [
                        "PubMed"
                    ],
                    "id": "2605230",
                    "url": "https://glygen.org/publication/PubMed/2605230"
                }
            ]
        }
    ],
    "residues": [],
    "composition": [
        {
            "name": "6-Deoxy-Hexose",
            "residue": "dhex",
            "count": 2,
            "cid": "840",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/840"
        },
        {
            "name": "Hexose",
            "residue": "hex",
            "count": 4,
            "cid": "206",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/206"
        },
        {
            "name": "N-Acetylhexosamine",
            "residue": "hexnac",
            "count": 2,
            "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": 1,
            "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": 2,
            "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": 2,
            "cid": "17106",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/17106"
        },
        {
            "name": "L-Fucitol",
            "residue": "fuc+aldi",
            "count": 0,
            "cid": "445724",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/445724"
        },
        {
            "name": "D-Galactose",
            "residue": "gal",
            "count": 3,
            "cid": "6036",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/6036"
        },
        {
            "name": "D-Galacitol",
            "residue": "gal+aldi",
            "count": 0,
            "cid": "11850",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/11850"
        },
        {
            "name": "D-Galactosamine",
            "residue": "galn",
            "count": 0,
            "cid": "24154",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/24154"
        },
        {
            "name": "N-Acetyl-D-galactosamine",
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            "cid": "35717",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/35717"
        },
        {
            "name": "N-Acetylgalactosaminitol",
            "residue": "galnac+aldi",
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            "cid": "165880",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/165880"
        },
        {
            "name": "D-Glucose",
            "residue": "glc",
            "count": 1,
            "cid": "5793",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/5793"
        },
        {
            "name": "D-Glucitol",
            "residue": "glc+aldi",
            "count": 0,
            "cid": "5780",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/5780"
        },
        {
            "name": "D-Glucuronic acid",
            "residue": "glca",
            "count": 0,
            "cid": "94715",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/94715"
        },
        {
            "name": "D-Glucosamine",
            "residue": "glcn",
            "count": 0,
            "cid": "439213",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/439213"
        },
        {
            "name": "N-Acetyl-D-Glucosamine",
            "residue": "glcnac",
            "count": 2,
            "cid": "439174",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/439174"
        },
        {
            "name": "N-Acetyl-D-glucosaminitol",
            "residue": "glcnac+aldi",
            "count": 0,
            "cid": "165206",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/165206"
        },
        {
            "name": "Hexose",
            "residue": "hex",
            "count": 4,
            "cid": "206",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/206"
        },
        {
            "name": "N-Acetylhexosamine",
            "residue": "hexnac",
            "count": 2,
            "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": "Hexitol",
            "residue": "hex+aldi",
            "count": 0,
            "cid": "453",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/453"
        },
        {
            "name": "N-Acetylhexosaminitol",
            "residue": "hexnac+aldi",
            "count": 0
        },
        {
            "name": "L-Iduronic acid",
            "residue": "idoa",
            "count": 0,
            "cid": "441039",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/441039"
        },
        {
            "name": "D-Mannose",
            "residue": "man",
            "count": 0,
            "cid": "18950",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/18950"
        },
        {
            "name": "D-Mannitol",
            "residue": "man+aldi",
            "count": 0,
            "cid": "6251",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/6251"
        },
        {
            "name": "D-Mannosamine",
            "residue": "mann",
            "count": 0,
            "cid": "440049",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/440049"
        },
        {
            "name": "N-Acetyl-D-mannosamine",
            "residue": "mannac",
            "count": 0,
            "cid": "439281",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/439281"
        },
        {
            "name": "Methyl",
            "residue": "me",
            "count": 0
        },
        {
            "name": "N-Acetyl-Neuraminic Acid",
            "residue": "neuac",
            "count": 1,
            "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": "Sialic acid",
            "residue": "sia",
            "count": 1,
            "cid": "906",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/906"
        },
        {
            "name": "Other",
            "residue": "other",
            "count": 0
        },
        {
            "name": "Floating substituent",
            "residue": "x",
            "count": 0
        },
        {
            "name": "D-Xylose",
            "residue": "xyl",
            "count": 0,
            "cid": "135191",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/135191"
        },
        {
            "name": "Ketodeoxynononic acid",
            "residue": "kdn",
            "count": 0,
            "cid": "13991616",
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/13991616"
        }
    ],
    "motifs": [
        {
            "id": "GGM.000001",
            "name": "Type 2 LN",
            "synonym": "N-acetyllactosamine",
            "keywords": "LacNAc; N-acetyllactosamine; N-acetyllactosamine type 2"
        },
        {
            "id": "GGM.000005",
            "name": "Type 1 LN",
            "synonym": "",
            "keywords": "LacNAc; N-acetyllactosamine; N-acetyllactosamine type 1"
        },
        {
            "id": "GGM.000018",
            "name": "Lewis x",
            "synonym": "Le^x; Lex; SSEA-1",
            "keywords": "Lewis x"
        },
        {
            "id": "GGM.000020",
            "name": "Lewis a",
            "synonym": "Le^a; Lea",
            "keywords": "Lewis a"
        },
        {
            "id": "GGM.000024",
            "name": "Sialyl Lewis a",
            "synonym": "CA19-9 antigen; SLe^a; SLea; Slea",
            "keywords": "Lewis a"
        }
    ],
    "interactions": [],
    "expression": [],
    "subsumption": [
        {
            "related_accession": "G06046KU",
            "relationship": "ancestor"
        },
        {
            "related_accession": "G17075TB",
            "relationship": "ancestor"
        },
        {
            "related_accession": "G22784CD",
            "relationship": "ancestor"
        },
        {
            "related_accession": "G31806HV",
            "relationship": "ancestor"
        },
        {
            "related_accession": "G37651NV",
            "relationship": "ancestor"
        },
        {
            "related_accession": "G46433HY",
            "relationship": "ancestor"
        },
        {
            "related_accession": "G73372SB",
            "relationship": "ancestor"
        },
        {
            "related_accession": "G87321EI",
            "relationship": "ancestor"
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        {
            "related_accession": "G98993TR",
            "relationship": "ancestor"
        },
        {
            "related_accession": "G98993TR",
            "relationship": "basecomposition"
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        {
            "related_accession": "G46433HY",
            "relationship": "composition"
        },
        {
            "related_accession": "G33255ZB",
            "relationship": "descendant"
        },
        {
            "related_accession": "G33255ZB",
            "relationship": "fullydetermined"
        },
        {
            "related_accession": "G33255ZB",
            "relationship": "leaf"
        },
        {
            "related_accession": "G17075TB",
            "relationship": "subsumedby"
        },
        {
            "related_accession": "G31806HV",
            "relationship": "subsumedby"
        },
        {
            "related_accession": "G33255ZB",
            "relationship": "subsumes"
        },
        {
            "related_accession": "G17075TB",
            "relationship": "topology"
        }
    ],
    "names": [],
    "keywords": [],
    "glycotree_pathways": [],
    "dictionary": {}
}