m-Nitrophenyl-beta-D-galactoside

Properties Image MNX_ID MNXM168278 reference sabiorkM:24705 formula C12H15NO8 global charge 0 mol weight 301.251 InChIKey VCCMGHVCRFMITI-YBXAARCKSA-N InChI InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-2-6(4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1 SMILES O=[N+]([O-])C1=CC(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)=CC=C1 MNX internals InChI (mnx) InChI=1/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-2-6(4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1 SMILES (mnx) [CH:1]1=[CH:2][C:6]([N+:13]([O-:18])=[O:19])=[CH:4][C:7]([O:20][C@H:12]2[C@H:11]([OH:17])[C@@H:10]([OH:16])[C@@H:9]([OH:15])[C@@H:8]([CH2:5][OH:14])[O:21]2)=[CH:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0