Marvin 06301115572D 118127 0 0 1 0 999 V2000 9.1376 -12.2815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1376 -11.4567 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8521 -11.0442 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4233 -11.0442 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8521 -10.2192 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.4233 -10.2192 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7088 -11.4567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1376 -9.8067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5665 -9.8067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7088 -9.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5665 -11.4567 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2811 -11.0442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9955 -11.4567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2811 -10.2192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2811 -7.7442 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2811 -8.5692 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5665 -7.3317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5665 -8.9817 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8521 -7.7442 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8521 -8.5692 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9955 -7.3317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9955 -8.9817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1376 -8.9817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1376 -7.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4232 -7.7442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1389 -6.0940 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1389 -6.9190 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4246 -5.6815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4246 -7.3317 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.7101 -6.0940 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7101 -6.9190 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.8535 -5.6815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8535 -7.3317 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4246 -8.1567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9955 -5.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2811 -6.0942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5654 -12.6942 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2799 -13.1067 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9944 -11.8692 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2798 -11.4567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9944 -12.6940 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5654 -11.8692 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7088 -13.1065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2799 -13.9317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8509 -13.1067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8509 -11.4567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1366 -11.8692 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9945 -14.3442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9944 -15.1692 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7089 -13.9315 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4233 -14.3440 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4233 -15.1690 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7089 -15.5817 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1376 -13.9315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1379 -15.5817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7091 -16.4067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2799 -15.5817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9944 -10.2192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5681 -6.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2825 -7.3317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5681 -6.0942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5681 -3.6190 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.5681 -4.4440 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.8535 -3.2065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8535 -4.8565 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.1392 -3.6190 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1392 -4.4440 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.2825 -3.2065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2825 -4.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4246 -4.8565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4246 -3.2065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7102 -3.6190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7114 -4.0315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4258 -1.9690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4258 -2.7940 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.7114 -1.5565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7114 -3.2065 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.9969 -1.9690 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.9969 -2.7940 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.1402 -1.5565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1402 -3.2065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2825 -1.5565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5679 -1.9690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5655 -7.7443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2798 -7.3319 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9942 -7.7443 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2798 -6.5070 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7087 -7.3318 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9943 -6.0944 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5653 -6.0944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7087 -6.5068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9942 -5.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9942 -8.5692 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4219 -4.8570 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4220 -5.6821 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8509 -5.6820 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8508 -4.8570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1366 -6.0945 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1364 -4.4446 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1366 -6.9194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7075 -6.0947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7074 -4.4446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1364 -3.6196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4219 -3.2071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7076 -6.9197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9931 -7.3321 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4222 -7.3320 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4222 -8.1570 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7077 -8.5695 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9931 -8.1571 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1367 -8.5694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7077 -9.3947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2788 -8.5699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2786 -6.9197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2798 -4.8570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2798 -8.9817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2798 -9.8067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5654 -8.5692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 2 1 1 1 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 6 0 0 0 4 6 1 0 0 0 0 4 7 1 6 0 0 0 5 8 1 0 0 0 0 5 9 1 1 0 0 0 6 10 1 1 0 0 0 6 8 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 20 1 0 0 0 0 15 21 1 1 0 0 0 16 22 1 6 0 0 0 18 9 1 1 0 0 0 20 23 1 1 0 0 0 19 24 1 1 0 0 0 25 24 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 30 31 1 0 0 0 0 26 32 1 1 0 0 0 27 33 1 6 0 0 0 29 34 1 1 0 0 0 31 21 1 6 0 0 0 30 35 1 1 0 0 0 36 35 1 0 0 0 0 37 45 1 1 0 0 0 38 37 1 0 0 0 0 38 44 1 1 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 41 38 1 0 0 0 0 41 43 1 6 0 0 0 42 37 1 0 0 0 0 40 42 1 0 0 0 0 42 46 1 1 0 0 0 46 47 1 0 0 0 0 49 48 1 0 0 0 0 50 48 1 0 0 0 0 50 43 1 1 0 0 0 50 51 1 0 0 0 0 51 54 1 1 0 0 0 51 52 1 0 0 0 0 52 55 1 6 0 0 0 52 53 1 0 0 0 0 53 49 1 0 0 0 0 53 56 1 6 0 0 0 49 57 1 6 0 0 0 39 7 1 1 0 0 0 10 58 1 0 0 0 0 33 59 1 0 0 0 0 59 60 1 0 0 0 0 59 61 2 0 0 0 0 62 63 1 0 0 0 0 62 64 1 0 0 0 0 63 65 1 0 0 0 0 64 66 1 0 0 0 0 65 67 1 0 0 0 0 66 67 1 0 0 0 0 62 68 1 1 0 0 0 63 69 1 6 0 0 0 65 32 1 1 0 0 0 67 70 1 1 0 0 0 66 71 1 1 0 0 0 72 71 1 0 0 0 0 74 75 1 0 0 0 0 74 76 1 0 0 0 0 75 77 1 0 0 0 0 76 78 1 0 0 0 0 77 79 1 0 0 0 0 78 79 1 0 0 0 0 74 80 1 0 0 0 0 75 81 1 6 0 0 0 77 73 1 1 0 0 0 79 68 1 6 0 0 0 78 82 1 1 0 0 0 83 82 1 0 0 0 0 85 86 1 0 0 0 0 85 84 1 1 0 0 0 85 87 1 0 0 0 0 86 88 1 0 0 0 0 86 93 1 6 0 0 0 87 89 1 0 0 0 0 87 90 1 6 0 0 0 88 91 1 0 0 0 0 88 25 1 1 0 0 0 89 92 1 1 0 0 0 89 91 1 0 0 0 0 94102 1 1 0 0 0 95 94 1 0 0 0 0 95101 1 1 0 0 0 96 97 1 0 0 0 0 96 98 1 0 0 0 0 98 95 1 0 0 0 0 98100 1 6 0 0 0 99 94 1 0 0 0 0 97 99 1 0 0 0 0 99103 1 1 0 0 0 103104 1 0 0 0 0 106105 1 0 0 0 0 107105 1 0 0 0 0 107100 1 1 0 0 0 107108 1 0 0 0 0 108111 1 1 0 0 0 108109 1 0 0 0 0 109112 1 6 0 0 0 109110 1 0 0 0 0 110106 1 0 0 0 0 110113 1 6 0 0 0 106114 1 6 0 0 0 96 90 1 1 0 0 0 92115 1 0 0 0 0 117116 2 0 0 0 0 118116 1 0 0 0 0 93116 1 0 0 0 0 M END > CHEBI:62483 > alpha-L-Fucp-(1->2)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-[alpha-L-Fucp-(1->2)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->6)]-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-D-Glcp > A branched ten-membered glucosamine oligosaccharide consisting of two fucose, three glucosamine, one glucose (at the reducing end) and four galactose units, linked as shown. > 3 > WURCS=2.0/4,10,9/[a2122h-1x_1-5][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][a1221m-1a_1-5]/1-2-3-2-3-2-4-3-2-4/a4-b1_b3-c1_c4-d1_d3-e1_d6-h1_e4-f1_f2-g1_h4-i1_i2-j1; alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-[alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->6)]-beta-D-galactosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-D-glucose; alpha-L-Fuc-(1->2)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-[alpha-L-Fuc-(1->2)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->6)]-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-D-Glc; 6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)]-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose; (Gal)4 (Glc)1 (GlcNAc)3 (LFuc)2 > alpha-L-fucopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)]-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose > C66H111N3O49 > 1730.57820 > 1729.62862 > 0 > C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2O[C@H]2[C@H](O)[C@@H](NC(C)=O)[C@H](OC[C@H]3O[C@@H](O[C@H]4[C@H](O)[C@@H](NC(C)=O)[C@@H](O[C@@H]4CO)O[C@H]4[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]5[C@H](O)[C@@H](O)C(O)O[C@@H]5CO)[C@@H]4O)[C@H](O)[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O[C@@H]5O[C@H](CO)[C@H](O)[C@H](O)[C@H]5O[C@@H]5O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]5O)[C@H](O)[C@H]4NC(C)=O)[C@H]3O)O[C@@H]2CO)[C@@H](O)[C@H](O)[C@@H]1O > InChI=1S/C66H111N3O49/c1-14-30(80)39(89)45(95)61(101-14)117-55-41(91)32(82)19(6-70)105-65(55)113-50-23(10-74)107-58(27(36(50)86)67-16(3)77)100-13-26-35(85)54(116-60-29(69-18(5)79)38(88)51(25(12-76)109-60)114-66-56(42(92)33(83)20(7-71)106-66)118-62-46(96)40(90)31(81)15(2)102-62)48(98)64(110-26)111-49-24(11-75)108-59(28(37(49)87)68-17(4)78)115-53-34(84)21(8-72)104-63(47(53)97)112-52-22(9-73)103-57(99)44(94)43(52)93/h14-15,19-66,70-76,80-99H,6-13H2,1-5H3,(H,67,77)(H,68,78)(H,69,79)/t14-,15-,19+,20+,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+,31+,32-,33-,34-,35-,36+,37+,38+,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-/m0/s1 > DAOMYAMWLFIDMG-WXJVAOFHSA-N > G12039 > 3944091 $$$$