4-O-(indol-3-ylacetyl)-beta-D-glucose

Properties Image MNX_ID MNXM11878 reference metacycM:INDOLE-3-ACETYL-BETA-4-D-GLUCOSE formula C16H19NO7 global charge 0 mol weight 337.328 InChIKey XSNPKRVRWPBMKE-JPIRQXTESA-N InChI InChI=1S/C16H19NO7/c18-7-11-15(13(20)14(21)16(22)23-11)24-12(19)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-18,20-22H,5,7H2/t11-,13-,14-,15-,16-/m1/s1 SMILES O=C(CC1=CNC2=C1C=CC=C2)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)O[C@@H]1CO MNX internals InChI (mnx) InChI=1/C16H19NO7/c18-7-11-15(13(20)14(21)16(22)23-11)24-12(19)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-18,20-22H,5,7H2/t11-,13-,14-,15-,16-/m1/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:10]2[C:9](=[CH:3]1)[C:8]([CH2:5][C:12](=[O:19])[O:24][C@@H:15]1[C@@H:11]([CH2:7][OH:18])[O:23][C@@H:16]([OH:22])[C@H:14]([OH:21])[C@H:13]1[OH:20])=[CH:6][NH:17]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0