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ST antigen

PropertiesImage
MNX_IDMNXM12937 Image of MNXM12937
referencebiggM:sT_antigen
formulaC25H40N2O18*
global charge-1
mol weight 
InChIKey 
InChI 
SMILES[*][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@]3(C(=O)[O-])C[C@H](O)[C@@H](NC(C)=O)C([C@H](O)[C@H](O)CO)O3)[C@H]2O)[C@H]1NC(C)=O
MNX internals
InChI (mnx)InChI=1/C26H44N2O18/c1-8-15(27-9(2)32)21(18(37)13(6-30)42-8)44-24-20(39)23(19(38)14(7-31)43-24)46-26(25(40)41)4-11(34)16(28-10(3)33)22(45-26)17(36)12(35)5-29/h8,11-24,29-31,34-39H,4-7H2,1-3H3,(H,27,32)(H,28,33)(H,40,41)/t8-,11+,12-,13-,14-,15+,16-,17-,18+,19+,20-,21-,22?,23+,24+,26+/m1/s1/i1+1 Image of MNXM12937
SMILES (mnx)[13CH3:1][C@@H:8]1[C@H:15]([N:27]=[C:9]([CH3:2])[OH:32])[C@@H:21]([O:44][C@H:24]2[C@H:20]([OH:39])[C@@H:23]([O:46][C@:26]3([C:25](=[O:40])[OH:41])[CH2:4][C@H:11]([OH:34])[C@@H:16]([N:28]=[C:10]([CH3:3])[OH:33])[CH:22]([C@@H:17]([C@@H:12]([CH2:5][OH:29])[OH:35])[OH:36])[O:45]3)[C@@H:19]([OH:38])[C@@H:14]([CH2:7][OH:31])[O:43]2)[C@@H:18]([OH:37])[C@@H:13]([CH2:6][OH:30])[O:42]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:sT_antigen
biggM:sT_antigen 		ST antigen

biggM:M_sT_antigen 		secondary/obsolete/fantasy identifier