3,4-Dinitrophenyl-beta-D-galactopyranoside

Properties Image MNX_ID MNXM166088 reference sabiorkM:24757 formula C12H13N2O10 global charge -1 mol weight 345.24 InChIKey JLFIWESWTKKJSR-YBXAARCKSA-N InChI InChI=1S/C12H13N2O10/c15-4-8-9(16)10(17)11(12(18)24-8)23-5-1-2-6(13(19)20)7(3-5)14(21)22/h1-3,8-12,15-17H,4H2/q-1/t8-,9+,10+,11-,12-/m1/s1 SMILES O=[N+]([O-])C1=C([N+](=O)[O-])C=C(O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2[O-])C=C1 MNX internals InChI (mnx) InChI=1/C12H13N2O10/c15-4-8-9(16)10(17)11(12(18)24-8)23-5-1-2-6(13(19)20)7(3-5)14(21)22/h1-3,8-12,15-17H,4H2/q-1/t8-,9+,10+,11-,12-/m1/s1 SMILES (mnx) [CH:1]1=[CH:2][C:6]([N+:13]([O-:19])=[O:20])=[C:7]([N+:14]([O-:21])=[O:22])[CH:3]=[C:5]1[O:23][C@@H:11]1[C@@H:10]([OH:17])[C@@H:9]([OH:16])[C@@H:8]([CH2:4][OH:15])[O:24][C@H:12]1[O-:18]

Parent-child relations graph

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