input word = C00056523

Metabolite InformationStructural formula
Name 1'-O-Galloylsucrose
Formula C19H26O15
Mw 494.12717016
CAS RN 115713-45-6
C_ID C00056523
InChIKey XPQHIVBLCNQLEF-RDWBPHHJSA-N
InChICode InChI=1S/C19H26O15/c20-3-9-12(25)14(27)15(28)18(32-9)34-19(16(29)13(26)10(4-21)33-19)5-31-17(30)6-1-7(22)11(24)8(23)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(OC[C@@]1(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[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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OrganismRheum spp.
ReferenceFukuyama, Y. et al., Phytochemistry, 1983, 22, 549-552 (Hydropiperoside)