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"detachedby": "", "id": "N33", "parentid": "N28", "name": "N-glycan_a-D-NeupNAc_33" }, { "attachedby": "rxn.O43825-1", "detachedby": "", "id": "N28", "parentid": "N7", "name": "N-glycan_b-D-Galp_28" }, { "attachedby": "rxn.P97325-1", "detachedby": "", "id": "N33", "parentid": "N28", "name": "N-glycan_a-D-NeupNAc_33" } ], "glycam": "DNeup5Aca2-3DGalpb1-3[DNeup5Aca2-6]DGlcpNAcb1-4[DNeup5Aca2-6DGalpb1-4DGlcpNAcb1-2]DManpa1-3[DNeup5Aca2-6DGalpb1-4DGlcpNAcb1-2DManpa1-6]DManpb1-4DGlcpNAcb1-4DGlcpNAcb1-", "inchi": 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"crossref": [ { "url": "https://pubchem.ncbi.nlm.nih.gov/compound/91859006", "id": "91859006", "database": "PubChem Compound" }, { "url": "https://glytoucan.org/Structures/Glycans/G03260OU", "id": "G03260OU", "database": "GlyTouCan" }, { "url": "https://raw.githack.com/CCRC-will/glycoTree/master/portal/explore.html?G03260OU", "id": "G03260OU", "database": "SandBox" }, { "url": "https://pubchem.ncbi.nlm.nih.gov/substance/252292527", "id": "252292527", "database": "PubChem Substance" }, { "url": "https://www.genome.jp/dbget-bin/www_bget?carbbank+36432", "id": "36432", "database": "CarbBank" }, { "url": "https://glyconnect.expasy.org/browser/structures/2310", "id": "2310", "database": "GlyConnect" }, { "url": "http://www.glycosciences.de/database/start.php?action=explore_linucsid&linucsid=4268", "id": "4268", "database": "Glycosciences.de" }, { "url": "https://www.glygen.org/glycan/G03260OU", "id": "G03260OU", "database": "GNOme" }, { "url": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=146524", "id": "146524", "database": "ChEBI" } ], "tool_support": { "sandbox": "yes", "gnome": "yes" }, "glycoct": "RES 1b:b-dglc-HEX-1:5 2s:n-acetyl 3b:b-dglc-HEX-1:5 4s:n-acetyl 5b:b-dman-HEX-1:5 6b:a-dman-HEX-1:5 7b:b-dglc-HEX-1:5 8s:n-acetyl 9b:b-dgal-HEX-1:5 10b:a-dgro-dgal-NON-2:6|1:a|2:keto|3:d 11s:n-acetyl 12b:b-dglc-HEX-1:5 13s:n-acetyl 14b:b-dgal-HEX-1:5 15b:a-dgro-dgal-NON-2:6|1:a|2:keto|3:d 16s:n-acetyl 17b:a-dgro-dgal-NON-2:6|1:a|2:keto|3:d 18s:n-acetyl 19b:a-dman-HEX-1:5 20b:b-dglc-HEX-1:5 21s:n-acetyl 22b:b-dgal-HEX-1:5 23b:a-dgro-dgal-NON-2:6|1:a|2:keto|3:d 24s:n-acetyl LIN 1:1d(2+1)2n 2:1o(4+1)3d 3:3d(2+1)4n 4:3o(4+1)5d 5:5o(3+1)6d 6:6o(2+1)7d 7:7d(2+1)8n 8:7o(4+1)9d 9:9o(6+2)10d 10:10d(5+1)11n 11:6o(4+1)12d 12:12d(2+1)13n 13:12o(3+1)14d 14:14o(3+2)15d 15:15d(5+1)16n 16:12o(6+2)17d 17:17d(5+1)18n 18:5o(6+1)19d 19:19o(2+1)20d 20:20d(2+1)21n 21:20o(4+1)22d 22:22o(6+2)23d 23:23d(5+1)24n", "iupac": "alpha-D-NeupAc-(2->6)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)[alpha-D-NeupAc-(2->3)-beta-D-Galp-(1->3)[alpha-D-NeupAc-(2->6)]-beta-D-GlcpNAc-(1->4)]-alpha-D-Manp-(1->3)[alpha-D-NeupAc-(2->6)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc-(1->", "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)OC[C@@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)O[C@@H]3[C@H](O[C@H]([C@@H]([C@H]3O)NC(=O)C)O[C@H]4[C@H]([C@@H]([C@H](O[C@@H]4OC[C@@H]5[C@H]([C@@H]([C@@H]([C@@H](O5)O[C@@H]6[C@H](O[C@H]([C@@H]([C@H]6O)NC(=O)C)O[C@@H]7[C@H](O[C@H]([C@@H]([C@H]7O)NC(=O)C)O)CO)CO)O)O[C@@H]8[C@H]([C@H]([C@@H]([C@H](O8)CO)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO[C@@]1(C[C@@H]([C@H]([C@@H](O1)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O[C@@]1(C[C@@H]([C@H]([C@@H](O1)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)NC(=O)C)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO[C@@]1(C[C@@H]([C@H]([C@@H](O1)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)O)O)NC(=O)C)O)CO)O)O)CO)O)O)O)O", "mass": 3170.11, "expression": [] }