Marvin 06041011042D 128138 0 0 1 0 999 V2000 16.9804 -5.0140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5501 -8.7266 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5501 -9.5516 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8355 -8.3141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8355 -9.9641 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1211 -8.7266 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1211 -9.5516 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2645 -8.3140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2645 -9.9641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8355 -10.7891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4066 -9.9640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4066 -8.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2658 -5.4265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2658 -6.2515 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.5514 -5.0140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5514 -6.6640 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.8368 -5.4265 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.8368 -6.2515 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.9804 -6.6640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5514 -7.4890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1224 -6.6640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1224 -5.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4080 -5.4265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9804 -7.4890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6948 -7.9016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2658 -7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4080 -7.0765 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4080 -7.9015 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.6935 -6.6640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6935 -8.3140 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9789 -7.0765 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9789 -7.9015 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1224 -8.3141 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.6935 -9.1390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2645 -6.6640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5501 -7.0766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1224 -9.1391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8368 -9.5516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4080 -9.5516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1211 -11.2016 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1211 -12.0266 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.4066 -10.7891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4066 -12.4391 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6920 -11.2016 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6920 -12.0266 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8355 -12.4391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4064 -13.2641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9776 -12.4391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9776 -10.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2632 -11.2016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8355 -13.2641 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.5499 -13.6766 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1210 -13.6766 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5499 -14.5016 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1210 -14.5016 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8355 -14.9141 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2645 -13.2641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2643 -14.9141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8355 -15.7391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4066 -14.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4066 -15.7391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4066 -7.4891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6922 -7.0765 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9776 -7.4890 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.6922 -6.2515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2632 -7.0765 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9776 -5.8390 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2632 -6.2515 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9776 -8.3140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5486 -7.4890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5488 -5.8390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9776 -5.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2632 -4.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8341 -7.0765 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1197 -7.4890 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.8341 -6.2515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4053 -7.0763 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1197 -5.8388 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4053 -6.2513 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1197 -8.3140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6907 -7.4887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6909 -5.8388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1197 -5.0140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4053 -8.7265 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4053 -9.5515 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6907 -8.3140 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6907 -9.9640 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9763 -8.7265 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.9763 -9.5515 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1197 -9.9640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6907 -10.7890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 -9.9640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 -8.3140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5472 -8.7265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8342 -4.6015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9789 -13.6766 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6935 -13.2641 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.9789 -14.5016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4079 -13.6768 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6933 -14.9141 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4079 -14.5018 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.6935 -12.4391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1224 -13.2643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1223 -14.9143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6933 -15.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4079 -16.1518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2632 -3.7765 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5487 -3.3640 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9777 -3.3640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5488 -2.5388 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9777 -2.5390 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2632 -2.1265 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8342 -3.7763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8344 -2.1262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 -1.3015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6922 -2.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6923 -1.3015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1198 -3.3638 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4053 -3.7762 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1198 -2.5387 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6909 -3.3636 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4054 -2.1262 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6909 -2.5387 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4053 -4.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9763 -3.7760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9765 -2.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4055 -1.3012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6910 -0.8886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 6 7 1 0 0 0 0 2 8 1 1 0 0 0 3 9 1 1 0 0 0 5 10 1 1 0 0 0 7 11 1 6 0 0 0 6 12 1 1 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 18 1 0 0 0 0 13 1 1 0 0 0 0 14 19 1 6 0 0 0 16 20 1 1 0 0 0 18 21 1 6 0 0 0 17 22 1 1 0 0 0 23 22 1 0 0 0 0 25 24 2 0 0 0 0 26 24 1 0 0 0 0 19 24 1 0 0 0 0 27 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 32 1 0 0 0 0 31 32 1 0 0 0 0 27 21 1 1 0 0 0 28 33 1 6 0 0 0 30 34 1 1 0 0 0 32 8 1 6 0 0 0 31 35 1 1 0 0 0 36 35 1 0 0 0 0 38 37 2 0 0 0 0 39 37 1 0 0 0 0 33 37 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 41 43 1 0 0 0 0 42 44 1 0 0 0 0 43 45 1 0 0 0 0 44 45 1 0 0 0 0 40 10 1 6 0 0 0 41 46 1 1 0 0 0 43 47 1 1 0 0 0 45 48 1 6 0 0 0 44 49 1 1 0 0 0 50 49 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 52 54 1 0 0 0 0 53 55 1 0 0 0 0 54 56 1 0 0 0 0 55 56 1 0 0 0 0 51 46 1 6 0 0 0 52 57 1 1 0 0 0 54 58 1 1 0 0 0 56 59 1 6 0 0 0 55 60 1 1 0 0 0 61 60 1 0 0 0 0 12 62 1 0 0 0 0 63 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 68 1 0 0 0 0 67 68 1 0 0 0 0 63 62 1 6 0 0 0 64 69 1 1 0 0 0 66 70 1 1 0 0 0 68 71 1 6 0 0 0 67 72 1 1 0 0 0 73 72 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 70 1 6 0 0 0 75 80 1 1 0 0 0 77 81 1 1 0 0 0 79 82 1 6 0 0 0 78 83 1 1 0 0 0 84 85 1 0 0 0 0 84 86 1 0 0 0 0 85 87 1 0 0 0 0 86 88 1 0 0 0 0 87 89 1 0 0 0 0 88 89 1 0 0 0 0 84 80 1 6 0 0 0 85 90 1 1 0 0 0 87 91 1 1 0 0 0 89 92 1 6 0 0 0 88 93 1 1 0 0 0 94 93 1 0 0 0 0 83 95 1 0 0 0 0 96 97 1 0 0 0 0 96 98 1 0 0 0 0 97 99 1 0 0 0 0 98100 1 0 0 0 0 99101 1 0 0 0 0 100101 1 0 0 0 0 97102 1 1 0 0 0 99103 1 1 0 0 0 101104 1 6 0 0 0 100105 1 1 0 0 0 106105 1 0 0 0 0 96 57 1 6 0 0 0 107108 1 0 0 0 0 107109 1 0 0 0 0 108110 1 0 0 0 0 109111 1 0 0 0 0 110112 1 0 0 0 0 111112 1 0 0 0 0 107 73 1 6 0 0 0 108113 1 1 0 0 0 110114 1 1 0 0 0 112115 1 6 0 0 0 111116 1 1 0 0 0 117116 1 0 0 0 0 118119 1 0 0 0 0 118120 1 0 0 0 0 119121 1 0 0 0 0 120122 1 0 0 0 0 121123 1 0 0 0 0 122123 1 0 0 0 0 118113 1 6 0 0 0 119124 1 1 0 0 0 121125 1 1 0 0 0 123126 1 6 0 0 0 122127 1 1 0 0 0 128127 1 0 0 0 0 M END > CHEBI:59579 > Man(a1-2)Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-3)[Man(a1-2)Man(a1-6)]Man(a1-6)]Man(b1-4)GlcNAc(b1-4)GlcNAc > A branched N-glycan derivative that is an undecasaccharide derivative consisting of nine D-mannosyl residues and two N-acetylglucosamine residues (one at the reducing end). > 3 > WURCS=2.0/4,11,10/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5]/1-2-3-4-4-4-4-4-4-4-4/a4-b1_b4-c1_c3-d1_c6-g1_d2-e1_e2-f1_g3-h1_g6-j1_h2-i1_j2-k1; Man9(GlcNAc)2; alpha-Manp-(1->2)-alpha-Manp-(1->2)-alpha-Manp-(1->3)-[alpha-Manp-(1->2)-alpha-Manp-(1->3)-[alpha-Manp-(1->2)-alpha-Manp-(1->6)]-alpha-Manp-(1->6)]-beta-Manp-(1->4)-beta-GlcpNAc-(1->4)-GlcpNAc; alpha-Man-(1->2)-alpha-Man-(1->2)-alpha-Man-(1->3)-[alpha-Man-(1->2)-alpha-Man-(1->3)-[alpha-Man-(1->2)-alpha-Man-(1->6)]-alpha-Man-(1->6)]-beta-Man-(1->4)-beta-GlcNAc-(1->4)-GlcNAc; alpha-D-Manp-(1->2)-alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-D-GlcpNAc; alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->3)-[alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->3)-[alpha-D-mannosyl-(1->2)-alpha-D-mannosyl-(1->6)]-alpha-D-mannosyl-(1->6)]-beta-D-mannosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucosyl-(1->4)-2-acetamido-2-deoxy-D-glucose; alpha-D-Man-(1->2)-alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->3)-[alpha-D-Man-(1->2)-alpha-D-Man-(1->6)]-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-D-GlcNAc > Manalpha1-2Manalpha1-2Manalpha1-3[Manalpha1-2Manalpha1-3(Manalpha1-2Manalpha1-6)Manalpha1-6]Manbeta1-4GlcNAcbeta1-4GlcNAc; alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->3)-[alpha-D-mannopyranosyl-(1->2)-alpha-D-mannopyranosyl-(1->6)]-alpha-D-mannopyranosyl-(1->6)]-beta-D-mannopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->4)-2-acetamido-2-deoxy-D-glucopyranose > C70H118N2O56 > 1883.66570 > 1882.64472 > 0 > CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@H]4O[C@H](CO[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H](O)[C@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]5O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@@H]1O > InChI=1S/C70H118N2O56/c1-14(82)71-27-38(93)52(23(10-80)110-60(27)107)121-61-28(72-15(2)83)39(94)53(24(11-81)118-61)122-66-51(106)55(124-69-59(46(101)35(90)21(8-78)116-69)128-70-58(45(100)34(89)22(9-79)117-70)127-65-49(104)42(97)31(86)18(5-75)113-65)37(92)26(120-66)12-108-62-50(105)54(123-68-57(44(99)33(88)20(7-77)115-68)126-64-48(103)41(96)30(85)17(4-74)112-64)36(91)25(119-62)13-109-67-56(43(98)32(87)19(6-76)114-67)125-63-47(102)40(95)29(84)16(3-73)111-63/h16-70,73-81,84-107H,3-13H2,1-2H3,(H,71,82)(H,72,83)/t16-,17-,18-,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+,67+,68-,69-,70-/m1/s1 > DINOPBPYOCMGGD-VEDJBHDQSA-N > 4215262 > 4215262 > G00374 > 1368297; 14527957; 8782408 $$$$