2-(beta-D-glucosyl)benzothiazole

Properties Image MNX_ID MNXM34706 reference chebi:45823 formula C13H15NO5S global charge 0 mol weight 297.332 InChIKey VXYWGTFRKRQDQI-DVYMNCLGSA-N InChI InChI=1S/C13H15NO5S/c15-5-7-9(16)10(17)11(18)12(19-7)13-14-6-3-1-2-4-8(6)20-13/h1-4,7,9-12,15-18H,5H2/t7-,9-,10+,11-,12-/m1/s1 SMILES OC[C@H]1O[C@@H](C2=NC3=CC=CC=C3S2)[C@H](O)[C@@H](O)[C@@H]1O MNX internals InChI (mnx) InChI=1/C13H15NO5S/c15-5-7-9(16)10(17)11(18)12(19-7)13-14-6-3-1-2-4-8(6)20-13/h1-4,7,9-12,15-18H,5H2/t7-,9-,10+,11-,12-/m1/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:8]2[C:6](=[CH:3]1)[N:14]=[C:13]([C@H:12]1[C@H:11]([OH:18])[C@@H:10]([OH:17])[C@H:9]([OH:16])[C@@H:7]([CH2:5][OH:15])[O:19]1)[S:20]2

Parent-child relations graph

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