[(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-5-Acetamido-6-[(2R,3S,4R,5S)-5-acetamido-4-[(2R,3R,4R,5S,6R)-3-acetamido-4-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,6-trihydroxyhexoxy]-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen sulfate

Properties Image Occurences in reactions MNX_ID MNXM1118633 #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0 formula C42H73N3O33S charge 0 mass 1179.3847 reference chebi:154933 InChIKey BEDSVTBZTVYNCM-GRGGCWTRSA-N InChI InChI=1S/C42H73N3O33S/c1-11-23(55)29(61)31(63)40(69-11)77-37-30(62)25(57)17(6-47)72-42(37)76-35-22(45-14(4)53)39(70-18(7-48)26(35)58)74-33(15(5-46)43-12(2)51)24(56)16(54)10-68-38-21(44-13(3)52)28(60)34(20(9-50)73-38)75-41-32(64)36(78-79(65,66)67)27(59)19(8-49)71-41/h11,15-42,46-50,54-64H,5-10H2,1-4H3,(H,43,51)(H,44,52)(H,45,53)(H,65,66,67)/t11-,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-/m0/s1 SMILES CC(=O)N[C@@H](CO)[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H]1NC(C)=O)[C@@H](O)[C@H](O)CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OS(=O)(=O)O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O

Parent-child relations graph

Deprecated MNXref IDs graph