Ketcher 04242315332D 1 1.00000 0.00000 0 116125 0 1 0 999 V2000 14.4584 -30.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4584 -31.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5924 -30.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5924 -32.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7263 -30.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7263 -31.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3244 -30.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3244 -32.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5924 -33.3027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8604 -32.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8604 -30.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9942 -30.8028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7263 -33.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7263 -34.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8601 -33.3027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8601 -35.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9942 -33.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9942 -34.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5924 -35.3028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8601 -36.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1281 -35.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1281 -33.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4584 -34.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4584 -33.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3244 -35.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5923 -36.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4583 -36.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7263 -36.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7263 -37.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5923 -38.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4583 -37.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8601 -38.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5923 -39.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3243 -38.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3243 -36.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1281 -32.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2622 -34.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3961 -35.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2622 -33.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5302 -34.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3961 -33.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5302 -33.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 -36.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 -35.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 -33.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3961 -32.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5302 -31.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 -36.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7979 -36.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5299 -36.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5299 -37.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 -38.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7979 -37.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3960 -38.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6639 -39.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9319 -38.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9319 -36.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0565 -31.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9226 -28.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9226 -29.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0565 -28.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0565 -30.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1904 -28.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1904 -29.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7885 -28.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7885 -30.3028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3244 -28.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4586 -28.8028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6547 -29.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6547 -28.8028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5206 -30.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7885 -31.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6547 -31.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9226 -31.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9226 -32.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7885 -33.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6547 -32.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0565 -33.3027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7885 -34.3027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5205 -33.3027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5205 -31.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6547 -25.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6547 -26.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7886 -25.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7886 -27.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9226 -25.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9226 -26.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5206 -25.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5206 -27.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0565 -27.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0565 -25.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1904 -25.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9850 -23.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1189 -23.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1189 -24.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2527 -23.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.2527 -25.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3868 -23.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3868 -24.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9850 -25.3028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.2527 -26.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5206 -23.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8511 -24.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8511 -23.8028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.7170 -25.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9849 -26.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.8509 -26.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1188 -26.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1188 -27.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9849 -28.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8509 -27.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2527 -28.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9849 -29.3028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.7168 -28.3029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.7168 -26.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6546 -23.8028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 4 6 1 0 0 0 5 6 1 0 0 0 1 7 1 1 0 0 2 8 1 6 0 0 4 9 1 1 0 0 6 10 1 1 0 0 5 11 1 1 0 0 12 11 1 0 0 0 13 14 1 0 0 0 13 15 1 0 0 0 14 16 1 0 0 0 15 17 1 0 0 0 16 18 1 0 0 0 17 18 1 0 0 0 13 9 1 1 0 0 14 19 1 6 0 0 16 20 1 1 0 0 18 21 1 6 0 0 17 22 1 1 0 0 24 23 2 0 0 0 25 23 1 0 0 0 19 23 1 0 0 0 27 26 1 0 0 0 28 26 1 0 0 0 28 20 1 6 0 0 28 29 1 0 0 0 29 32 1 6 0 0 29 30 1 0 0 0 30 33 1 1 0 0 30 31 1 0 0 0 31 27 1 0 0 0 31 34 1 1 0 0 27 35 1 1 0 0 22 36 1 0 0 0 37 38 1 0 0 0 37 39 1 0 0 0 38 40 1 0 0 0 39 41 1 0 0 0 40 42 1 0 0 0 41 42 1 0 0 0 38 43 1 6 0 0 40 44 1 1 0 0 42 45 1 1 0 0 41 46 1 1 0 0 47 46 1 0 0 0 37 21 1 1 0 0 49 48 1 0 0 0 50 48 1 0 0 0 50 43 1 1 0 0 50 51 1 0 0 0 51 54 1 1 0 0 51 52 1 0 0 0 52 55 1 6 0 0 52 53 1 0 0 0 53 49 1 0 0 0 53 56 1 6 0 0 49 57 1 6 0 0 59 60 1 0 0 0 59 61 1 0 0 0 60 62 1 0 0 0 61 63 1 0 0 0 62 64 1 0 0 0 63 64 1 0 0 0 59 65 1 1 0 0 60 66 1 6 0 0 62 58 1 1 0 0 64 7 1 6 0 0 63 67 1 1 0 0 68 67 1 0 0 0 70 69 2 0 0 0 71 69 1 0 0 0 66 69 1 0 0 0 73 72 1 0 0 0 74 72 1 0 0 0 74 58 1 6 0 0 74 75 1 0 0 0 75 78 1 6 0 0 75 76 1 0 0 0 76 79 1 1 0 0 76 77 1 0 0 0 77 73 1 0 0 0 77 80 1 1 0 0 73 81 1 1 0 0 82 83 1 0 0 0 82 84 1 0 0 0 83 85 1 0 0 0 84 86 1 0 0 0 85 87 1 0 0 0 86 87 1 0 0 0 82 88 1 1 0 0 83 89 1 6 0 0 85 65 1 1 0 0 87 90 1 1 0 0 86 91 1 1 0 0 92 91 1 0 0 0 94 95 1 0 0 0 94 96 1 0 0 0 95 97 1 0 0 0 96 98 1 0 0 0 97 99 1 0 0 0 98 99 1 0 0 0 94 93 1 1 0 0 95100 1 6 0 0 97101 1 1 0 0 99 88 1 6 0 0 98102 1 1 0 0 104103 2 0 0 0 105103 1 0 0 0 100103 1 0 0 0 107106 1 0 0 0 108106 1 0 0 0 108101 1 6 0 0 108109 1 0 0 0 109112 1 6 0 0 109110 1 0 0 0 110113 1 1 0 0 110111 1 0 0 0 111107 1 0 0 0 111114 1 1 0 0 107115 1 1 0 0 102116 1 0 0 0 M END > CHEBI:67160 > alpha-L-Fuc-(1->2)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]GlcNAc-(1->3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc > A branched amino heptasaccharide consisting of three repeating units of β-D-Gal-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc joined by (1→3)-linkages with an α-L-fucosyl residue attached at the 2-position of the galactose residue at the non-reducing end. > 3 > O-6-deoxy-alpha-L-galactopyranosyl-(1->3)-O-[O-6-deoxy-alpha-L-galactopyranosyl-(1->3)-O-[O-6-deoxy-alpha-L-galactopyranosyl-(1->3)-O-[O-6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)]-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-2-(acetylamino)-2-deoxy-beta-D-glucopyranose; Fucalpha1-2Galbeta1-4(Fucalpha1-3)GlcNAcbeta1-3Galbeta1-4(Fucalpha1-3)GlcNAcbeta1-3Galbeta1-4(Fucalpha1-3)GlcNAc; Fuca1-2Galb1-4(Fuca1-3)GlcNAcb1-3Galb1-4(Fuca1-3)GlcNAcb1-3Galb1-4(Fuca1-3)GlcNAcb; beta-D-glucopyranose, O-6-deoxy-alpha-L-galactopyranosyl-(1->3)-O-[O-6-deoxy-alpha-L-galactopyranosyl-(1->3)-O-[O-6-deoxy-alpha-L-galactopyranosyl-(1->3)-O-[O-6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)]-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-O-2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-2-(acetylamino)-2-deoxy-; alpha-L-Fucp-(1->2)-beta-D-Galp-(1->4)-[alpha-L-Fucp-(1->3)]-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-[alpha-L-Fucp-(1->3)]GlcpNAc-(1->3)-beta-D-Galp-(1->4)-[alpha-L-Fucp-(1->3)]-beta-D-GlcpNAc; alpha-L-fucosyl-(1->3)-[alpha-L-fucosyl-(1->3)-[alpha-L-fucosyl-(1->3)-[alpha-L-fucosyl-(1->2)-beta-D-galactosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)]-N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)]-N-acetyl-beta-D-glucosamine; 6-deoxy-alpha-L-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-glucopyranose > alpha-L-fucopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->3)-[alpha-L-fucopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-2-acetamido-2-deoxy-beta-D-glucopyranose > C66H111N3O47 > 1698.588 > 1697.63879 > 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](CO)O[C@@H](O[C@H]3[C@@H](O)[C@@H](CO)O[C@@H](O[C@@H]4[C@@H](CO)O[C@@H](O[C@H]5[C@@H](O)[C@@H](CO)O[C@@H](O[C@@H]6[C@@H](CO)O[C@@H](O)[C@H](NC(C)=O)[C@H]6O[C@@H]6O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]6O)[C@@H]5O)[C@H](NC(C)=O)[C@H]4O[C@@H]4O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]4O)[C@@H]3O)[C@H](NC(C)=O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@@H]1O > InChI=1S/C66H111N3O47/c1-14-30(79)37(86)42(91)60(98-14)111-51-27(67-18(5)76)57(97)102-24(11-73)48(51)108-64-46(95)54(35(84)22(9-71)103-64)114-58-28(68-19(6)77)52(112-61-43(92)38(87)31(80)15(2)99-61)49(25(12-74)106-58)109-65-47(96)55(36(85)23(10-72)104-65)115-59-29(69-20(7)78)53(113-62-44(93)39(88)32(81)16(3)100-62)50(26(13-75)107-59)110-66-56(41(90)34(83)21(8-70)105-66)116-63-45(94)40(89)33(82)17(4)101-63/h14-17,21-66,70-75,79-97H,8-13H2,1-7H3,(H,67,76)(H,68,77)(H,69,78)/t14-,15-,16-,17-,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 > GVABRQDZDOQHHU-VQOQPUTESA-N > 25568069; 31537530 $$$$