beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc

Properties Image MNX_ID MNXM103152 reference chebi:71357 formula C36H61N3O26 global charge 0 mol weight 951.879 InChIKey GJEPDYXUPJTULH-ZPYAIDHRSA-N InChI InChI=1S/C36H61N3O26/c1-9(45)37-17-24(52)28(15(7-43)57-32(17)56)62-35-27(55)31(22(50)14(6-42)59-35)65-34-19(39-11(3)47)25(53)29(16(8-44)61-34)63-36-26(54)30(21(49)13(5-41)60-36)64-33-18(38-10(2)46)23(51)20(48)12(4-40)58-33/h12-36,40-44,48-56H,4-8H2,1-3H3,(H,37,45)(H,38,46)(H,39,47)/t12-,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-,25-,26-,27-,28-,29-,30+,31+,32-,33+,34+,35+,36+/m1/s1 SMILES 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](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5NC(C)=O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@H]2O)[C@@H](CO)O[C@H]1O MNX internals InChI (mnx) InChI=1/C36H61N3O26/c1-9(45)37-17-24(52)28(15(7-43)57-32(17)56)62-35-27(55)31(22(50)14(6-42)59-35)65-34-19(39-11(3)47)25(53)29(16(8-44)61-34)63-36-26(54)30(21(49)13(5-41)60-36)64-33-18(38-10(2)46)23(51)20(48)12(4-40)58-33/h12-36,40-44,48-56H,4-8H2,1-3H3,(H,37,45)(H,38,46)(H,39,47)/t12-,13-,14-,15-,16-,17-,18-,19-,20-,21+,22+,23-,24-,25-,26-,27-,28-,29-,30+,31+,32-,33+,34+,35+,36+/m1/s1 SMILES (mnx) [CH3:1][C:9](=[N:37][C@@H:17]1[C@@H:24]([OH:52])[C@H:28]([O:62][C@H:35]2[C@H:27]([OH:55])[C@@H:31]([O:65][C@H:34]3[C@H:19]([N:39]=[C:11]([CH3:3])[OH:47])[C@@H:25]([OH:53])[C@H:29]([O:63][C@H:36]4[C@H:26]([OH:54])[C@@H:30]([O:64][C@H:33]5[C@H:18]([N:38]=[C:10]([CH3:2])[OH:46])[C@@H:23]([OH:51])[C@H:20]([OH:48])[C@@H:12]([CH2:4][OH:40])[O:58]5)[C@@H:21]([OH:49])[C@@H:13]([CH2:5][OH:41])[O:60]4)[C@@H:16]([CH2:8][OH:44])[O:61]3)[C@@H:22]([OH:50])[C@@H:14]([CH2:6][OH:42])[O:59]2)[C@@H:15]([CH2:7][OH:43])[O:57][C@H:32]1[OH:56])[OH:45]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0