4'-O-Galloylsucrose

Properties Image MNX_ID MNXM117718 reference hmdb:HMDB0039284 formula C19H26O15 global charge 0 mol weight 494.402 InChIKey VQNOKSMTUKSLMO-UHFFFAOYSA-N InChI InChI=1S/C19H26O15/c20-3-9-12(26)13(27)14(28)18(31-9)34-19(5-22)16(29)15(10(4-21)33-19)32-17(30)6-1-7(23)11(25)8(24)2-6/h1-2,9-10,12-16,18,20-29H,3-5H2 SMILES O=C(OC1C(CO)OC(CO)(OC2OC(CO)C(O)C(O)C2O)C1O)C1=CC(O)=C(O)C(O)=C1 MNX internals InChI (mnx) InChI=1/C19H26O15/c20-3-9-12(26)13(27)14(28)18(31-9)34-19(5-22)16(29)15(10(4-21)33-19)32-17(30)6-1-7(23)11(25)8(24)2-6/h1-2,9-10,12-16,18,20-29H,3-5H2/t9?,10?,12?,13?,14?,15?,16?,18?,19? SMILES (mnx) [CH:1]1=[C:6]([C:17](=[O:30])[O:32][CH:15]2[CH:10]([CH2:4][OH:21])[O:33][C:19]([CH2:5][OH:22])([O:34][CH:18]3[CH:14]([OH:28])[CH:13]([OH:27])[CH:12]([OH:26])[CH:9]([CH2:3][OH:20])[O:31]3)[CH:16]2[OH:29])[CH:2]=[C:8]([OH:24])[C:11]([OH:25])=[C:7]1[OH:23]

Parent-child relations graph

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