Marvin 02111114272D 81 87 0 0 1 0 999 V2000 13.6980 -4.1362 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6980 -4.9611 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9835 -3.7237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9835 -5.3738 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2690 -4.1362 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.2690 -4.9611 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.4124 -3.7237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4124 -5.3738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9835 -6.1987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5545 -5.3738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5545 -3.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8399 -4.1362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2690 -6.6113 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.2690 -7.4363 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.5544 -6.1987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5544 -7.8488 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8399 -6.6113 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8399 -7.4363 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.9835 -7.8488 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5544 -8.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1254 -7.8488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1254 -6.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6980 -7.4364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6980 -6.6113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4124 -7.8489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9834 -8.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6979 -9.0864 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2689 -9.0864 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2689 -9.9114 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9834 -10.3238 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6979 -9.9114 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.5544 -10.3239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9834 -11.1489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4123 -10.3239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4123 -8.6738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1254 -5.3737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4110 -7.4363 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6965 -7.8488 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4110 -6.6113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9820 -7.4363 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6965 -6.1988 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9820 -6.6112 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6963 -8.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2675 -7.8488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2675 -6.1988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6965 -5.3738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9820 -4.9613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2674 -8.6739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5529 -9.0864 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9819 -9.0864 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.9819 -9.9114 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2674 -10.3238 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5529 -9.9114 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.6963 -10.3239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2673 -11.1489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8384 -10.3239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8384 -8.6738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8414 -4.5488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5559 -2.4862 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.5559 -3.3112 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.8414 -2.0737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8414 -3.7237 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.1269 -2.4862 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.1269 -3.3112 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.2704 -2.0737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2704 -3.7237 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4124 -2.0737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6981 -2.4862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9849 -3.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9849 -2.4862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6994 -3.7237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2704 -4.5488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9849 -4.9613 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.5559 -4.9613 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.5559 -5.7863 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 17.2704 -6.1987 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.9849 -5.7863 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.8414 -6.1987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2704 -7.0237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6993 -6.1987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6993 -4.5487 0.0000 C 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 9 1 1 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 24 23 2 0 0 0 0 25 23 1 0 0 0 0 19 23 1 0 0 0 0 27 26 1 0 0 0 0 28 26 1 0 0 0 0 28 20 1 6 0 0 0 28 29 1 0 0 0 0 29 32 1 6 0 0 0 29 30 1 0 0 0 0 30 33 1 1 0 0 0 30 31 1 0 0 0 0 31 27 1 0 0 0 0 31 34 1 1 0 0 0 27 35 1 1 0 0 0 22 36 1 0 0 0 0 37 38 1 0 0 0 0 37 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 42 1 0 0 0 0 38 43 1 6 0 0 0 40 44 1 1 0 0 0 42 45 1 1 0 0 0 41 46 1 1 0 0 0 47 46 1 0 0 0 0 37 21 1 1 0 0 0 49 48 1 0 0 0 0 50 48 1 0 0 0 0 50 43 1 1 0 0 0 50 51 1 0 0 0 0 51 54 1 1 0 0 0 51 52 1 0 0 0 0 52 55 1 6 0 0 0 52 53 1 0 0 0 0 53 49 1 0 0 0 0 53 56 1 6 0 0 0 49 57 1 6 0 0 0 59 60 1 0 0 0 0 59 61 1 0 0 0 0 60 62 1 0 0 0 0 61 63 1 0 0 0 0 62 64 1 0 0 0 0 63 64 1 0 0 0 0 59 65 1 1 0 0 0 60 66 1 6 0 0 0 62 58 1 1 0 0 0 64 7 1 6 0 0 0 63 67 1 1 0 0 0 68 67 1 0 0 0 0 70 69 2 0 0 0 0 71 69 1 0 0 0 0 66 69 1 0 0 0 0 73 72 1 0 0 0 0 74 72 1 0 0 0 0 74 58 1 6 0 0 0 74 75 1 0 0 0 0 75 78 1 6 0 0 0 75 76 1 0 0 0 0 76 79 1 1 0 0 0 76 77 1 0 0 0 0 77 73 1 0 0 0 0 77 80 1 1 0 0 0 73 81 1 1 0 0 0 M END > CHEBI:61332 > 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)]-beta-D-GlcpNAc > A branched heptasaccharide derivative consisting of two repeating units of β-D-Gal-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc (joined by a (1→3)-linkage) with an α-L-fucosyl residue attached at the 2-position of the galactose residue at the non-reducing end. > 3 > WURCS=2.0/3,7,6/[a2122h-1b_1-5_2*NCC/3=O][a1221m-1a_1-5][a2112h-1b_1-5]/1-2-3-1-2-3-2/a3-b1_a4-c1_c3-d1_d3-e1_d4-f1_f2-g1; 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)]-2-(acetylamino)-2-deoxy-beta-D-glucopyranose; H. pylori P466 LPS O-antigen; Fucalpha1-2Galbeta1-4(Fucalpha1-3)GlcNAcbeta1-3Galbeta1-4(Fucalpha1-3)GlcNAcbeta; Fuca1-2Galb1-4(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->2)-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->3)-[alpha-L-Fucp-(1->3)-[alpha-L-Fucp-(1->2)-beta-D-Galp-(1->4)]-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)]-beta-D-GlcpNAc; 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-glucosamine; alpha-L-Fuc-(1->3)-[alpha-L-Fuc-(1->3)-[alpha-L-Fuc-(1->2)-beta-D-Gal-(1->4)]-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)]-beta-D-GlcNAc; alpha-L-Fuc-(1->2)-[3)-beta-D-Gal-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc-(1->]2; 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-glucopyranose; (Gal)2 (GlcNAc)2 (LFuc)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-glucopyranose > C46H78N2O33 > 1187.10510 > 1186.44868 > 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](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/C46H78N2O33/c1-10-21(55)26(60)30(64)42(69-10)78-36-19(47-13(4)53)40(68)72-17(8-51)34(36)76-45-33(67)38(25(59)16(7-50)73-45)80-41-20(48-14(5)54)37(79-43-31(65)27(61)22(56)11(2)70-43)35(18(9-52)75-41)77-46-39(29(63)24(58)15(6-49)74-46)81-44-32(66)28(62)23(57)12(3)71-44/h10-12,15-46,49-52,55-68H,6-9H2,1-5H3,(H,47,53)(H,48,54)/t10-,11-,12-,15+,16+,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-/m0/s1 > GOYFBGKOMRFQPC-FELDWXRZSA-N > G02259 > 25568069; 31537530; 8675304 $$$$