N-[(2R,3R,4R,5S,6R)-5-[(2S,3R,4R,5S,6R)-3-Acetamido-5-[(2S,3S,4S,5R,6R)-4-[(2R,3S,4S,5S,6R)-3-[(2S,3R,4R,5S,6R)-3-acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5-dihydroxy-6-[[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxy-4-hydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide

Properties Image MNX_ID MNXM1113020 reference chebi:147098 formula C48H81N3O36 global charge 0 mol weight 1276.161 InChIKey NORRDFDHCMLSMT-ITWWESPWSA-N InChI InChI=1S/C48H81N3O36/c1-11(58)49-21-29(66)37(18(8-56)76-42(21)74)83-43-22(50-12(2)59)30(67)38(19(9-57)81-43)84-47-36(73)40(28(65)20(82-47)10-75-45-34(71)31(68)24(61)14(4-52)78-45)86-48-41(33(70)26(63)16(6-54)80-48)87-44-23(51-13(3)60)39(27(64)17(7-55)77-44)85-46-35(72)32(69)25(62)15(5-53)79-46/h14-48,52-57,61-74H,4-10H2,1-3H3,(H,49,58)(H,50,59)(H,51,60)/t14-,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+,47+,48-/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]3O[C@H](CO[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[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]5O)[C@H]4NC(C)=O)[C@@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@@H](CO)O[C@H]1O MNX internals InChI (mnx) InChI=1/C48H81N3O36/c1-11(58)49-21-29(66)37(18(8-56)76-42(21)74)83-43-22(50-12(2)59)30(67)38(19(9-57)81-43)84-47-36(73)40(28(65)20(82-47)10-75-45-34(71)31(68)24(61)14(4-52)78-45)86-48-41(33(70)26(63)16(6-54)80-48)87-44-23(51-13(3)60)39(27(64)17(7-55)77-44)85-46-35(72)32(69)25(62)15(5-53)79-46/h14-48,52-57,61-74H,4-10H2,1-3H3,(H,49,58)(H,50,59)(H,51,60)/t14-,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+,47+,48-/m1/s1 SMILES (mnx) [CH3:1][C:11](=[N:49][C@@H:21]1[C@@H:29]([OH:66])[C@H:37]([O:83][C@H:43]2[C@H:22]([N:50]=[C:12]([CH3:2])[OH:59])[C@@H:30]([OH:67])[C@H:38]([O:84][C@H:47]3[C@@H:36]([OH:73])[C@@H:40]([O:86][C@@H:48]4[C@@H:41]([O:87][C@H:44]5[C@H:23]([N:51]=[C:13]([CH3:3])[OH:60])[C@@H:39]([O:85][C@H:46]6[C@H:35]([OH:72])[C@@H:32]([OH:69])[C@@H:25]([OH:62])[C@@H:15]([CH2:5][OH:53])[O:79]6)[C@H:27]([OH:64])[C@@H:17]([CH2:7][OH:55])[O:77]5)[C@@H:33]([OH:70])[C@H:26]([OH:63])[C@@H:16]([CH2:6][OH:54])[O:80]4)[C@H:28]([OH:65])[C@@H:20]([CH2:10][O:75][C@@H:45]4[C@@H:34]([OH:71])[C@@H:31]([OH:68])[C@H:24]([OH:61])[C@@H:14]([CH2:4][OH:52])[O:78]4)[O:82]3)[C@@H:19]([CH2:9][OH:57])[O:81]2)[C@@H:18]([CH2:8][OH:56])[O:76][C@H:42]1[OH:74])[OH:58]

Parent-child relations graph

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