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"InChI=1S/C87H144N6O65/c1-20(104)88-40-52(119)66(30(11-98)139-75(40)133)150-77-42(90-22(3)106)54(121)70(34(15-102)144-77)154-83-65(132)72(155-85-74(60(127)48(115)29(10-97)142-85)157-79-44(92-24(5)108)56(123)69(33(14-101)146-79)153-82-64(131)59(126)49(116)37(148-82)19-138-87(86(134)135)6-25(109)39(93-38(111)16-103)71(158-87)45(112)26(110)7-94)51(118)36(147-83)18-137-84-73(156-78-43(91-23(4)107)55(122)68(32(13-100)145-78)152-81-63(130)58(125)47(114)28(9-96)141-81)61(128)50(117)35(149-84)17-136-76-41(89-21(2)105)53(120)67(31(12-99)143-76)151-80-62(129)57(124)46(113)27(8-95)140-80/h25-37,39-85,94-103,109-110,112-133H,6-19H2,1-5H3,(H,88,104)(H,89,105)(H,90,106)(H,91,107)(H,92,108)(H,93,111)(H,134,135)/t25-,26+,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+,39+,40+,41+,42+,43+,44+,45+,46-,47-,48+,49-,50+,51+,52+,53+,54+,55+,56+,57-,58-,59-,60-,61-,62+,63+,64+,65-,66+,67+,68+,69+,70+,71+,72-,73-,74-,75+,76+,77-,78-,79-,80-,81-,82-,83-,84-,85+,87+/m0/s1", "crossref": [ { "url": "https://pubchem.ncbi.nlm.nih.gov/substance/252287004", "id": "252287004", "database": "PubChem Substance" }, { "url": "https://www.glygen.org/glycan/G06191GU", "id": "G06191GU", "database": "GNOme" }, { "url": "https://www.ebi.ac.uk/chebi/searchId.do?chebiId=146947", "id": "146947", "database": "ChEBI" }, { "url": "https://raw.githack.com/CCRC-will/glycoTree/master/portal/explore.html?G06191GU", "id": "G06191GU", "database": "SandBox" }, { "url": "https://pubchem.ncbi.nlm.nih.gov/compound/91854397", "id": "91854397", "database": "PubChem Compound" }, { "url": "https://glytoucan.org/Structures/Glycans/G06191GU", "id": "G06191GU", "database": "GlyTouCan" } ], "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-glycolyl 12b:a-dman-HEX-1:5 13b:b-dglc-HEX-1:5 14s:n-acetyl 15b:b-dgal-HEX-1:5 16b:b-dglc-HEX-1:5 17s:n-acetyl 18b:b-dgal-HEX-1:5 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 11:5o(6+1)12d 12:12o(2+1)13d 13:13d(2+1)14n 14:13o(4+1)15d 15:12o(6+1)16d 16:16d(2+1)17n 17:16o(4+1)18d", "iupac": "alpha-D-NeupGc-(2->6)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->3)[beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)[beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->6)]-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@@H]([C@H](O[C@H]1O)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O[C@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO[C@@H]4[C@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)CO)O)O)O)O)NC(=O)C)O)O)O[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)NC(=O)C)O)O[C@@H]9[C@H]([C@H]([C@@H]([C@H](O9)CO)O)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)CO)O)C(=O)O)O)O)O)O)NC(=O)C)O)O)NC(=O)C)O", "mass": 2312.81, "expression": [] }