Marvin 02131214482D 74 78 0 0 1 0 999 V2000 6.4591 -12.0967 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4591 -12.9217 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7445 -11.6842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7445 -13.3342 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.0301 -12.0967 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.0301 -12.9217 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1735 -11.6842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1735 -13.3342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7445 -14.1592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3156 -13.3342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3156 -11.6842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6012 -12.0967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8867 -11.6842 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4742 -12.3987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2992 -10.9697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1722 -11.2717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 -10.4467 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3170 -11.2717 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.6025 -10.0342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6025 -11.6842 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.8880 -10.4467 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8880 -11.2717 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0314 -10.0342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0314 -11.6842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6025 -12.5092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1735 -10.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4591 -10.4467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7446 -10.0342 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3321 -10.7487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1571 -9.3197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0301 -9.6217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7460 -7.9717 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7460 -8.7967 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0314 -7.5592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0314 -9.2092 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.3170 -7.9717 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3170 -8.7967 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.4604 -7.5592 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4604 -9.2092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6025 -9.2092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6025 -7.5592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8881 -7.9717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6039 -6.3217 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6039 -7.1467 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8894 -5.9092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8894 -7.5592 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.1749 -6.3217 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1749 -7.1467 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.3183 -5.9092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3183 -7.5592 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8894 -8.3842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4604 -5.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7460 -6.3217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0329 -3.8467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0329 -4.6717 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.3183 -3.4342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3183 -5.0842 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.6039 -3.8467 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.6039 -4.6717 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.7473 -3.4342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7473 -5.0842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8894 -5.0842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8894 -3.4342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1750 -3.8467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0315 -5.9092 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6190 -6.6236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4440 -5.1947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 -5.4967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3183 -8.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0328 -8.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0314 -12.5092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7459 -12.9217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3169 -12.9217 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6038 -8.7967 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 14 13 2 0 0 0 0 15 13 2 0 0 0 0 16 13 1 0 0 0 0 12 13 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 22 1 0 0 0 0 17 23 1 1 0 0 0 18 24 1 6 0 0 0 20 25 1 1 0 0 0 22 7 1 6 0 0 0 21 26 1 1 0 0 0 27 26 1 0 0 0 0 29 28 2 0 0 0 0 30 28 2 0 0 0 0 31 28 1 0 0 0 0 27 28 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 35 37 1 0 0 0 0 36 37 1 0 0 0 0 32 38 1 1 0 0 0 33 39 1 6 0 0 0 35 23 1 1 0 0 0 37 40 1 1 0 0 0 36 41 1 1 0 0 0 42 41 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 44 46 1 0 0 0 0 45 47 1 0 0 0 0 46 48 1 0 0 0 0 47 48 1 0 0 0 0 43 49 1 1 0 0 0 44 50 1 6 0 0 0 46 51 1 1 0 0 0 48 38 1 6 0 0 0 47 52 1 1 0 0 0 53 52 1 0 0 0 0 54 55 1 0 0 0 0 54 56 1 0 0 0 0 55 57 1 0 0 0 0 56 58 1 0 0 0 0 57 59 1 0 0 0 0 58 59 1 0 0 0 0 54 60 1 0 0 0 0 55 61 1 6 0 0 0 57 49 1 1 0 0 0 59 62 1 1 0 0 0 58 63 1 1 0 0 0 64 63 1 0 0 0 0 66 65 2 0 0 0 0 67 65 2 0 0 0 0 68 65 1 0 0 0 0 53 65 1 0 0 0 0 50 69 1 0 0 0 0 69 70 1 0 0 0 0 24 71 1 0 0 0 0 71 72 1 0 0 0 0 71 73 2 0 0 0 0 69 74 2 0 0 0 0 M END > CHEBI:63846 > beta-D-Galp6S-(1->4)-beta-D-GlcpNAc6S-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc6S-(1->3)-D-Galp > An amino pentasaccharide comprised of two N-acetylated glucosamine residues sulfated on O-6, and three galactosyl residues, one of which (at the non-reducing end) is sulfated on O-6 while another of which is at the reducing end. It is an intermediate in the keratan sulfate degradation pathway. > 3 > beta-D-Gal6S-(1->4)-beta-D-GlcNAc6S-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc6S-(1->3)-D-Gal > 6-O-sulfo-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-6-O-sulfo-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-6-O-sulfo-beta-D-glucopyranosyl-(1->3)-D-galactopyranose > C34H58N2O35S3 > 1151.01200 > 1150.19823 > 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]3O[C@H](COS(O)(=O)=O)[C@@H](O[C@@H]4O[C@H](COS(O)(=O)=O)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@H]2O)[C@@H](COS(O)(=O)=O)O[C@H]1O[C@@H]1[C@@H](O)C(O)O[C@H](CO)[C@@H]1O > InChI=1S/C34H58N2O35S3/c1-8(39)35-15-21(45)27(14(7-62-74(57,58)59)66-31(15)70-28-18(42)10(3-37)63-30(50)24(28)48)69-34-25(49)29(19(43)11(4-38)64-34)71-32-16(36-9(2)40)20(44)26(13(67-32)6-61-73(54,55)56)68-33-23(47)22(46)17(41)12(65-33)5-60-72(51,52)53/h10-34,37-38,41-50H,3-7H2,1-2H3,(H,35,39)(H,36,40)(H,51,52,53)(H,54,55,56)(H,57,58,59)/t10-,11-,12-,13-,14-,15-,16-,17+,18+,19+,20-,21-,22+,23-,24-,25-,26-,27-,28+,29+,30?,31+,32+,33+,34+/m1/s1 > IPSMOUOOQLUTHC-OVYIXGPZSA-N > G13031 $$$$