{
    "glytoucan_ac": "G03044ED", 
    "mass": 1127.39, 
    "iupac": "alpha-D-NeupAc-(2->3)-beta-D-Galp-(1->3)[alpha-D-NeupAc-(2->3)-beta-D-Galp-(1->4)]-beta-D-GlcpNAc(1->", 
    "wurcs": "WURCS=2.0/3,5,4/[a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O]/1-2-3-2-3/a3-b1_a4-d1_b3-c2_d3-e2", 
    "glycoct": "RES\\n1b:b-dglc-HEX-1:5\\n2s:n-acetyl\\n3b:b-dgal-HEX-1:5\\n4b:a-dgro-dgal-NON-2:6|1:a|2:keto|3:d\\n5s:n-acetyl\\n6b:b-dgal-HEX-1:5\\n7b:a-dgro-dgal-NON-2:6|1:a|2:keto|3:d\\n8s:n-acetyl\\nLIN\\n1:1d(2+1)2n\\n2:1o(3+1)3d\\n3:3o(3+2)4d\\n4:4d(5+1)5n\\n5:1o(4+1)6d\\n6:6o(3+2)7d\\n7:7d(5+1)8n", 
    "species": [], 
    "classification": [
        {
            "subtype": {
                "url": "", 
                "name": "Other"
            }, 
            "type": {
                "url": "", 
                "name": "Other"
            }
        }
    ], 
    "enzyme": [], 
    "crossref": [
        {
            "url": "http://www.functionalglycomics.org/glycomics/CarbohydrateServlet?pageType=view&view=view&operationType=view&carbId=carbSynthe_0597_D000", 
            "id": "carbSynthe_0597_D000", 
            "database": "CFG"
        }, 
        {
            "url": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=71594", 
            "id": "71594", 
            "database": "ChEBI"
        }, 
        {
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/CID70698370", 
            "id": "CID70698370", 
            "database": "PubChem"
        }, 
        {
            "url": "https://pubchem.ncbi.nlm.nih.gov/substance/SID252288483", 
            "id": "SID252288483", 
            "database": "PubChem"
        }
    ], 
    "glycoprotein": [], 
    "mass_pme": 1421.72, 
    "inchi_key": {
        "url": "https://pubchem.ncbi.nlm.nih.gov/compound/MJLWBGNNRFKTKY-AAOFEPKHSA-N", 
        "key": "MJLWBGNNRFKTKY-AAOFEPKHSA-N"
    }, 
    "publication": [], 
    "smiles_isomeric": "CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](CO)O)O)(C(=O)O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O[C@@]5(C[C@@H]([C@H]([C@@H](O5)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)NC(=O)C)O)CO)CO)O)O", 
    "residues": [], 
    "composition": [
        {
            "residue": "other", 
            "count": 0, 
            "name": "Other"
        }, 
        {
            "residue": "dhex", 
            "count": 0, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/840", 
            "name": "6-Deoxy-Hexose", 
            "cid": "840"
        }, 
        {
            "residue": "hexa", 
            "count": 0, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/610", 
            "name": "Hexuronic Acid", 
            "cid": "610"
        }, 
        {
            "residue": "neugc", 
            "count": 0, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/440001", 
            "name": "N-Glycolyl-Neuraminic Acid", 
            "cid": "440001"
        }, 
        {
            "residue": "hex", 
            "count": 2, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/206", 
            "name": "Hexose", 
            "cid": "206"
        }, 
        {
            "residue": "hexnac", 
            "count": 1, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/899", 
            "name": "N-Acetylhexosamine", 
            "cid": "899"
        }, 
        {
            "residue": "hexn", 
            "count": 0, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/739", 
            "name": "2-Amino-2-Deoxy-Hexose", 
            "cid": "739"
        }, 
        {
            "residue": "p", 
            "count": 0, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/1061", 
            "name": "Phosphate", 
            "cid": "1061"
        }, 
        {
            "residue": "s", 
            "count": 0, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/1117", 
            "name": "Sulfate", 
            "cid": "1117"
        }, 
        {
            "residue": "neuac", 
            "count": 2, 
            "url": "https://pubchem.ncbi.nlm.nih.gov/compound/439197", 
            "name": "N-Acetyl-Neuraminic Acid", 
            "cid": "439197"
        }
    ], 
    "glycam": "DNeup5Aca2-3DGalpb1-3[DNeup5Aca2-3DGalpb1-4]DGlcpNAcb1-", 
    "number_monosaccharides": 5, 
    "motifs": [
        {
            "id": "G00055MO", 
            "name": "Lactosamine motif"
        }, 
        {
            "id": "G00056MO", 
            "name": "Neo Lactosamine"
        }, 
        {
            "id": "G00065MO", 
            "name": "VIM"
        }
    ], 
    "inchi": "InChI=1S/C42H69N3O32/c1-11(51)43-21-14(54)4-41(39(65)66,74-31(21)24(58)16(56)6-46)76-34-26(60)18(8-48)70-37(28(34)62)72-30-20(10-50)69-36(64)23(45-13(3)53)33(30)73-38-29(63)35(27(61)19(9-49)71-38)77-42(40(67)68)5-15(55)22(44-12(2)52)32(75-42)25(59)17(57)7-47/h14-38,46-50,54-64H,4-10H2,1-3H3,(H,43,51)(H,44,52)(H,45,53)(H,65,66)(H,67,68)/t14-,15-,16+,17+,18+,19+,20+,21+,22+,23+,24+,25+,26-,27-,28+,29+,30+,31+,32+,33+,34-,35-,36+,37-,38-,41-,42-/m0/s1"
}
