Marvin 04121112532D 59 63 0 0 1 0 999 V2000 13.4482 -39.6388 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4482 -40.4638 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7337 -39.2263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7337 -40.8763 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.0193 -39.6388 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.0193 -40.4638 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1626 -39.2263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1626 -40.8765 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7337 -41.7013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3047 -40.8763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3047 -39.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1626 -41.7015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8771 -42.1140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4482 -42.1138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5902 -41.2890 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5902 -42.1140 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8758 -40.8765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8758 -42.5265 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1613 -41.2890 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1613 -42.1140 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3047 -42.5265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8757 -43.3514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4469 -42.5263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4469 -40.8765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7324 -41.2890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3047 -38.4015 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5902 -37.9888 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8758 -38.4013 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5902 -37.1638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1613 -37.9888 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.8758 -36.7513 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1613 -37.1638 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.8757 -39.2263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4468 -38.4012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4468 -36.7513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8758 -35.9263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1613 -35.5138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7324 -36.3388 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0178 -36.7512 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7324 -35.5137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3032 -36.3386 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0178 -35.1012 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3032 -35.5137 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0177 -37.5762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5887 -36.7511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5888 -35.1011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0178 -34.2762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3033 -33.8637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8772 -37.1638 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.8772 -37.9888 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.1626 -36.7513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1626 -38.4013 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.4482 -37.1638 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.4482 -37.9888 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.5916 -36.7513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5916 -38.4013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7337 -38.4013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7337 -36.7513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0193 -37.1638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 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 6 1 0 0 0 0 1 7 1 1 0 0 0 2 8 1 6 0 0 0 4 9 1 1 0 0 0 6 10 1 6 0 0 0 5 11 1 1 0 0 0 8 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 10 1 1 0 0 0 16 21 1 6 0 0 0 18 22 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 11 26 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 26 1 1 0 0 0 28 33 1 6 0 0 0 30 34 1 1 0 0 0 32 35 1 6 0 0 0 31 36 1 1 0 0 0 37 36 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 39 41 1 0 0 0 0 40 42 1 0 0 0 0 41 43 1 0 0 0 0 42 43 1 0 0 0 0 38 35 1 1 0 0 0 39 44 1 6 0 0 0 41 45 1 1 0 0 0 43 46 1 1 0 0 0 42 47 1 1 0 0 0 48 47 1 0 0 0 0 49 50 1 0 0 0 0 49 51 1 0 0 0 0 50 52 1 0 0 0 0 51 53 1 0 0 0 0 52 54 1 0 0 0 0 53 54 1 0 0 0 0 49 55 1 1 0 0 0 50 56 1 6 0 0 0 52 7 1 1 0 0 0 54 57 1 1 0 0 0 53 58 1 1 0 0 0 59 58 1 0 0 0 0 M END > CHEBI:61851 > beta-D-Galp-(1->4)-[beta-D-Galp-(1->4)-beta-D-Glcp-(1->6)]-beta-D-GlcpNAc-(1->3)-beta-D-Galp > A branched amino pentasaccharide having β-D-galactose at the reducing end with a β-D-galactosyl-(1→4)-[β-D-galactosyl-(1→4)-β-D-glucosyl-(1→6)]-N-acetyl-β-D-glucosaminyl moiety at the 3-position. > 3 > WURCS=2.0/3,5,4/[a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][a2122h-1b_1-5]/1-2-1-3-1/a3-b1_b4-c1_b6-d1_d4-e1 > beta-D-galactopyranosyl-(1->4)-[beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->6)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranose > C32H55NO26 > 869.77020 > 869.30123 > 0 > CC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)O[C@H]1O[C@@H]1[C@@H](O)[C@H](O)O[C@H](CO)[C@@H]1O > InChI=1S/C32H55NO26/c1-7(38)33-13-17(42)26(58-32-22(47)19(44)15(40)9(3-35)54-32)12(56-29(13)59-27-16(41)10(4-36)52-28(50)24(27)49)6-51-30-23(48)20(45)25(11(5-37)55-30)57-31-21(46)18(43)14(39)8(2-34)53-31/h8-32,34-37,39-50H,2-6H2,1H3,(H,33,38)/t8-,9-,10-,11-,12-,13-,14+,15+,16+,17-,18+,19+,20-,21-,22-,23-,24-,25-,26-,27+,28-,29+,30-,31+,32+/m1/s1 > SOHDKALVEKZCCL-LEEOCJEISA-N > 18678667 $$$$