input word = C00056522

Metabolite InformationStructural formula
Name 4'-O-Galloylsucrose
Formula C19H26O15
Mw 494.12717016
CAS RN 115713-44-5
C_ID C00056522
InChIKey VQNOKSMTUKSLMO-WXPJIXGRSA-N
InChICode 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/t9-,10-,12-,13+,14-,15-,16+,18-,19+/m1/s1
SMILES O=C(O[C@@H]1[C@@H](CO)O[C@@](CO)(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygonaceaeRheum spp. Ref.
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