Synonyms: | related_synonym: | 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-alpha-D-manno-hexopyranosyl-(1->3)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->2)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->3)-beta-D-galacto-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->6)]-alpha-D-manno-hexopyranosyl-(1->6)][2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1->4)-[6-deoxy-alpha-L-galacto-hexopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-gluco-hexopyranose; Formula=C123H201N9O89; InChI=1S/C123H201N9O89/c1-29-66(160)81(175)84(178)111(194-29)192-27-55-95(76(170)60(105(184)195-55)127-33(5)148)208-109-64(131-37(9)152)79(173)93(51(23-142)202-109)212-116-89(183)103(214-112-85(179)83(177)94(53(25-144)204-112)207-108-63(130-36(8)151)78(172)91(50(22-141)201-108)210-114-87(181)101(73(167)47(19-138)198-114)220-122(119(187)188)12-40(155)58(125-31(3)146)98(217-122)68(162)43(158)15-134)96(213-107-61(128-34(6)149)75(169)70(164)45(17-136)196-107)56(206-116)28-193-117-104(215-110-65(132-38(10)153)80(174)92(52(24-143)203-110)211-115-88(182)102(74(168)48(20-139)199-115)221-123(120(189)190)13-41(156)59(126-32(4)147)99(218-123)69(163)44(159)16-135)82(176)71(165)54(205-117)26-191-106-62(129-35(7)150)77(171)90(49(21-140)200-106)209-113-86(180)100(72(166)46(18-137)197-113)219-121(118(185)186)11-39(154)57(124-30(2)145)97(216-121)67(161)42(157)14-133/h29,39-117,133-144,154-184H,11-28H2,1-10H3,(H,124,145)(H,125,146)(H,126,147)(H,127,148)(H,128,149)(H,129,150)(H,130,151)(H,131,152)(H,132,153)(H,185,186)(H,187,188)(H,189,190)/t29-,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-,86+,87+,88-,89-,90+,91+,92+,93+,94+,95+,96+,97+,98+,99+,100-,101-,102-,103+,104-,105+,106+,107-,108-,109-,110-,111+,112+,113-,114-,115-,116-,117-,121-,122-,123-/m0/s1; InChIKey=DHYINLLTWDXOCM-LLXNWQDESA-N; NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-4)Man(a1-3)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-2)[NeuAc(a2-3)Gal(b1-4)GlcNAc(b1-6)]Man(a1-6)][GlcNAc(b1-4)]Man(b1-4)GlcNAc(b1-4)[Fuc(a1-6)]b-GlcNAc; SMILES=O1[C@@H]([C@@H](O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O[C@H]3O[C@@H]([C@@H](O[C@@H]4O[C@@H]([C@@H](O[C@@H]5O[C@@H]([C@H](O)[C@H](O[C@]6(O[C@H]([C@H](NC(=O)C)[C@@H](O)C6)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]5O)CO)[C@H](O)[C@H]4NC(=O)C)CO)[C@H](O)[C@@H]3O)CO)[C@H](O)[C@@H]1O[C@H]7[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]7CO)O[C@H]8[C@H](O)[C@@H](NC(=O)C)[C@@H](O[C@@H]8CO[C@@H]9O[C@H]([C@@H](O)[C@@H](O)[C@@H]9O)C)O)CO[C@H]%10O[C@@H]([C@@H](O)[C@H](O)[C@@H]%10O[C@@H]%11O[C@@H]([C@@H](O[C@@H]%12O[C@@H]([C@H](O)[C@H](O[C@]%13(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%13)[C@H](O)[C@H](O)CO)C(O)=O)[C@@H]%12O)CO)[C@H](O)[C@H]%11NC(=O)C)CO)CO[C@@H]%14O[C@@H]([C@@H](O[C@@H]%15O[C@@H]([C@H](O)[C@H](O[C@]%16(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%16)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]%15O)CO)[C@H](O)[C@H]%14NC(=O)C)CO; WURCS=2.0/6,16,15/[a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O][a1221m-1a_1-5]/1-1-2-3-1-4-5-1-3-1-4-5-1-4-5-6/a4-b1_a6-p1_b4-c1_c3-d1_c4-h1_c6-i1_d4-e1_e4-f1_f3-g2_i2-j1_i6-m1_j4-k1_k3-l2_m4-n1_n3-o2 |