Marvin 04111112182D 37 39 0 0 1 0 999 V2000 8.1488 -8.6675 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1488 -9.4925 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4343 -8.2550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4343 -9.9050 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.7198 -8.6675 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7198 -9.4925 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8633 -8.2550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8633 -9.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4343 -10.7300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0054 -9.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0054 -8.2550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2909 -8.6675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0067 -7.0175 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0067 -7.8425 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.2922 -6.6050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2922 -8.2550 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5778 -7.0175 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5778 -7.8425 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.7212 -6.6050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7212 -8.2550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2922 -9.0800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8633 -6.6050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1488 -7.0175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5791 -6.6050 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.5791 -7.4300 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.8646 -6.1925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8646 -7.8425 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.1501 -6.6050 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.1501 -7.4300 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.2936 -6.1925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2936 -7.8425 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8646 -8.6675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4357 -7.8425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4357 -6.1925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2936 -8.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0080 -9.0800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5791 -9.0800 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 1 0 0 0 5 11 1 1 0 0 0 12 11 1 0 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 19 1 1 0 0 0 14 20 1 6 0 0 0 16 21 1 1 0 0 0 18 7 1 6 0 0 0 17 22 1 1 0 0 0 23 22 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 28 29 1 0 0 0 0 24 30 1 1 0 0 0 25 31 1 6 0 0 0 27 32 1 1 0 0 0 29 33 1 6 0 0 0 28 34 1 1 0 0 0 19 34 1 0 0 0 0 31 35 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 M END > CHEBI:61824 > beta-D-Galp-(1->4)-beta-D-Glcp-(1->6)-beta-D-GlcpNAc > A linear amino trisaccharide consisting of N-acetyl-β-D-glucosamine at the reducing end having a β-D-galactosyl-(1→4)-β-D-glucosyl group attached at the 6-position. > 3 > WURCS=2.0/3,3,2/[a2122h-1b_1-5_2*NCC/3=O][a2122h-1b_1-5][a2112h-1b_1-5]/1-2-3/a6-b1_b4-c1 > beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->6)-2-acetamido-2-deoxy-beta-D-glucopyranose > C20H35NO16 > 545.48900 > 545.19558 > 0 > CC(=O)N[C@H]1[C@H](O)O[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)[C@@H](O)[C@@H]1O > InChI=1S/C20H35NO16/c1-5(24)21-9-12(27)11(26)8(34-18(9)32)4-33-19-16(31)14(29)17(7(3-23)36-19)37-20-15(30)13(28)10(25)6(2-22)35-20/h6-20,22-23,25-32H,2-4H2,1H3,(H,21,24)/t6-,7-,8-,9-,10+,11-,12-,13+,14-,15-,16-,17-,18-,19-,20+/m1/s1 > YRSGVLKUPIDFEV-JYBNDVMISA-N > 18678667 $$$$