Ketcher 03011717382D 1 1.00000 0.00000 0 38 40 0 1 0 999 V2000 13.4888 -47.9699 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3573 -45.4638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3573 -46.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4890 -44.9623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4890 -46.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6208 -45.4638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6208 -46.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2255 -44.9623 0.0000 * 0 0 0 0 0 0 0 0 0 0 0 0 15.2255 -46.9676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7525 -46.9676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7525 -44.9623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8842 -45.4638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7525 -43.9597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0159 -49.9752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8842 -47.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8842 -48.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0159 -46.9676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0159 -48.9726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1477 -47.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1477 -48.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7525 -48.9726 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2794 -48.9726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2794 -46.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4112 -47.4688 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2254 -48.9727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0936 -48.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9619 -46.9677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0936 -47.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8302 -47.4689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8302 -48.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9619 -48.9728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9619 -49.9754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6984 -48.9728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6985 -46.9678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7010 -46.1060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5666 -47.4691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4349 -46.9679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.8366 -46.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 4 6 1 0 0 0 5 7 1 0 0 0 6 7 1 0 0 0 2 8 1 6 0 0 3 9 1 6 0 0 5 1 1 1 0 0 7 10 1 1 0 0 6 11 1 1 0 0 12 11 1 0 0 0 11 13 2 0 0 0 15 16 1 0 0 0 15 17 1 0 0 0 16 18 1 0 0 0 17 19 1 0 0 0 18 20 1 0 0 0 19 20 1 0 0 0 15 10 1 6 0 0 16 21 1 6 0 0 18 14 1 1 0 0 20 22 1 1 0 0 19 23 1 1 0 0 24 23 1 0 0 0 26 25 1 6 0 0 28 27 1 0 0 0 29 27 1 0 0 0 26 28 1 0 0 0 30 29 1 0 0 0 31 26 1 0 0 0 31 30 1 0 0 0 28 9 1 1 0 0 31 32 1 6 0 0 30 33 1 1 0 0 29 34 1 0 0 0 34 35 1 6 0 0 34 36 1 0 0 0 36 37 1 0 0 0 29 38 1 1 0 0 M END > CHEBI:136367 > alpha-D-GalN-(1->4)-[alpha-DD-Hep-(1->2)]-alpha-D-GalA-yl group > A galactosyl group obtained by removing the hydroxy group from the hemiacetal function of the branched trisaccharide α-D-galactosaminyl-(1→4)-[D-glycero-α-D-manno-heptopyranosyl-(1→2)]-α-D-galacturonic acid. > 3 > alpha-GalN-(1->4)-[alpha-DD-Hep-(1->2)]-alpha-GalA-; alpha-D-GalpN-(1->4)-[alpha-DD-Hepp-(1->2)]-alpha-D-GalpA-yl group; alpha-D-GalpN-(1->4)-[alpha-DD-Hepp-(1->2)]-alpha-D-GalpA-yl; alpha-D-galactosaminyl-(1->4)-[D-glycero-alpha-D-manno-heptosyl-(1->2)]-alpha-D-galacturonosyl > 2-amino-2-deoxy-alpha-D-galactopyranosyl-(1->4)-[D-glycero-alpha-D-manno-heptopyranosyl-(1->2)]-alpha-D-galactopyranuronosyl > C19H32NO16 > 530.455 > 530.17211 > 0 > O[C@@H]1[C@H]([C@H](O[C@@H]([C@@H]1O[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)N)C(O)=O)*)O[C@H]3O[C@@]([C@H]([C@@H]([C@@H]3O)O)O)([C@H](O)CO)[H] > 27469376 $$$$