Synonyms: | related_synonym: | 5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosylonic acid-(2->6)-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->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)]-beta-D-manno-hexopyranosyl-(1->4)-2-acetamido-2-deoxy-D-gluco-hexopyranose; Formula=C126H205N9O93; InChI=1S/C126H205N9O93/c1-30(149)127-59-39(158)10-123(119(190)191,222-97(59)68(166)43(162)14-136)200-29-58-72(170)83(181)85(183)112(211-58)214-93-52(23-145)208-111(67(81(93)179)135-38(9)157)221-106-86(184)96(213-109-65(133-36(7)155)80(178)94(53(24-146)206-109)217-115-89(187)103(75(173)48(19-141)203-115)227-125(121(194)195)12-41(160)61(129-32(3)151)99(224-125)70(168)45(164)16-138)55(26-148)209-118(106)219-101-77(175)57(210-113(87(101)185)215-91-50(21-143)201-107(189)63(78(91)176)131-34(5)153)28-199-117-105(220-110-66(134-37(8)156)82(180)95(54(25-147)207-110)218-116-90(188)104(76(174)49(20-142)204-116)228-126(122(196)197)13-42(161)62(130-33(4)152)100(225-126)71(169)46(165)17-139)84(182)73(171)56(212-117)27-198-108-64(132-35(6)154)79(177)92(51(22-144)205-108)216-114-88(186)102(74(172)47(18-140)202-114)226-124(120(192)193)11-40(159)60(128-31(2)150)98(223-124)69(167)44(163)15-137/h39-118,136-148,158-189H,10-29H2,1-9H3,(H,127,149)(H,128,150)(H,129,151)(H,130,152)(H,131,153)(H,132,154)(H,133,155)(H,134,156)(H,135,157)(H,190,191)(H,192,193)(H,194,195)(H,196,197)/t39-,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-,118+,123+,124-,125-,126-/m0/s1; InChIKey=DXMCFHNFQAJJHP-KIGKYMCMSA-N; NeuAc(a2-6)Gal(b1-4)GlcNAc(b1-2)[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)]Man(b1-4)GlcNAc; SMILES=O([C@H]1[C@H](O)[C@H](O[C@@H]2O[C@@H]([C@@H](O[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3O)CO[C@]4(O[C@H]([C@H](NC(=O)C)[C@@H](O)C4)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H]2NC(=O)C)CO)[C@H](O[C@@H]1CO)O[C@H]5[C@H](O)[C@H](O[C@@H](O[C@H]6[C@H](O)[C@@H](NC(=O)C)C(O[C@@H]6CO)O)[C@H]5O)CO[C@H]7O[C@@H]([C@@H](O)[C@H](O)[C@@H]7O[C@@H]8O[C@@H]([C@@H](O[C@@H]9O[C@@H]([C@H](O)[C@H](O[C@]%10(O[C@H]([C@H](NC(=O)C)[C@@H](O)C%10)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]9O)CO)[C@H](O)[C@H]8NC(=O)C)CO)CO[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)[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-1x_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5][a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5][Aad21122h-2a_2-6_5*NCC/3=O]/1-2-3-4-5-6-4-5-6-3-4-5-6-4-5-6/a4-b1_b3-c1_b6-j1_c2-d1_c4-g1_d4-e1_e6-f2_g4-h1_h3-i2_j2-k1_j6-n1_k4-l1_l3-m2_n4-o1_o3-p2 |