alpha-NeuNAc-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->3)-[beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->2)-alpha-D-Man-(1->6)]-beta-D-Man-(1->4)-beta-D-GlcNAc-(1->4)-beta-D-GlcNAc-yl group

Properties Image MNX_ID MNXM41558 reference chebi:63500 formula C79H130N5O58* global charge 0 mol weight   InChIKey   InChI   SMILES [*][C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[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]6O[C@H](CO)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5NC(C)=O)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@]5(C(=O)O)C[C@H](O)[C@@H](NC(C)=O)[C@H]([C@H](O)[C@H](O)CO)O5)[C@H]4O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@H](O)[C@H]1NC(C)=O MNX internals InChI (mnx) InChI=1/C80H133N5O58/c1-19-37(81-20(2)96)49(110)60(32(14-92)124-19)135-75-58(119)66(139-78-69(55(116)45(106)29(11-89)129-78)141-72-41(85-24(6)100)52(113)63(35(17-95)132-72)137-76-59(120)67(47(108)31(13-91)127-76)143-80(79(121)122)7-25(101)38(82-21(3)97)64(142-80)42(103)26(102)8-86)48(109)36(133-75)18-123-77-68(54(115)44(105)28(10-88)128-77)140-71-40(84-23(5)99)51(112)62(34(16-94)131-71)136-74-57(118)65(46(107)30(12-90)126-74)138-70-39(83-22(4)98)50(111)61(33(15-93)130-70)134-73-56(117)53(114)43(104)27(9-87)125-73/h19,25-78,86-95,101-120H,7-18H2,1-6H3,(H,81,96)(H,82,97)(H,83,98)(H,84,99)(H,85,100)(H,121,122)/t19-,25-,26+,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37-,38+,39+,40+,41+,42+,43-,44+,45+,46-,47-,48+,49+,50+,51+,52+,53-,54-,55-,56+,57+,58-,59+,60+,61+,62+,63+,64+,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78+,80-/m0/s1/i1+1 SMILES (mnx) [13CH3:1][C@H:19]1[C@H:37]([N:81]=[C:20]([CH3:2])[OH:96])[C@@H:49]([OH:110])[C@H:60]([O:135][C@H:75]2[C@@H:58]([OH:119])[C@@H:66]([O:139][C@@H:78]3[C@@H:69]([O:141][C@H:72]4[C@H:41]([N:85]=[C:24]([CH3:6])[OH:100])[C@@H:52]([OH:113])[C@H:63]([O:137][C@H:76]5[C@H:59]([OH:120])[C@@H:67]([O:143][C@:80]6([C:79](=[O:121])[OH:122])[CH2:7][C@H:25]([OH:101])[C@@H:38]([N:82]=[C:21]([CH3:3])[OH:97])[C@H:64]([C@@H:42]([C@@H:26]([CH2:8][OH:86])[OH:102])[OH:103])[O:142]6)[C@@H:47]([OH:108])[C@@H:31]([CH2:13][OH:91])[O:127]5)[C@@H:35]([CH2:17][OH:95])[O:132]4)[C@@H:55]([OH:116])[C@H:45]([OH:106])[C@@H:29]([CH2:11][OH:89])[O:129]3)[C@H:48]([OH:109])[C@@H:36]([CH2:18][O:123][C@@H:77]3[C@@H:68]([O:140][C@H:71]4[C@H:40]([N:84]=[C:23]([CH3:5])[OH:99])[C@@H:51]([OH:112])[C@H:62]([O:136][C@H:74]5[C@H:57]([OH:118])[C@@H:65]([O:138][C@H:70]6[C@H:39]([N:83]=[C:22]([CH3:4])[OH:98])[C@@H:50]([OH:111])[C@H:61]([O:134][C@H:73]7[C@H:56]([OH:117])[C@@H:53]([OH:114])[C@@H:43]([OH:104])[C@@H:27]([CH2:9][OH:87])[O:125]7)[C@@H:33]([CH2:15][OH:93])[O:130]6)[C@@H:46]([OH:107])[C@@H:30]([CH2:12][OH:90])[O:126]5)[C@@H:34]([CH2:16][OH:94])[O:131]4)[C@@H:54]([OH:115])[C@H:44]([OH:105])[C@@H:28]([CH2:10][OH:88])[O:128]3)[O:133]2)[C@@H:32]([CH2:14][OH:92])[O:124]1

Parent-child relations graph

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