input word = C00059641

Metabolite InformationStructural formula
Name 3,6-Di-O-galloyl-D-glucose
3,6-Di-O-galloylglucose
Formula C20H20O14
Mw 484.08530535
CAS RN 13186-20-4
C_ID C00059641
InChIKey RINHWYYBAWQTFZ-MJSCVDMRSA-N
InChICode InChI=1S/C20H20O14/c21-5-13(26)18(34-20(32)8-3-11(24)16(29)12(25)4-8)17(30)14(27)6-33-19(31)7-1-9(22)15(28)10(23)2-7/h1-5,13-14,17-18,22-30H,6H2/t13-,14+,17+,18+/m0/s1
SMILES O=CC(O)C(OC(=O)c1cc(O)c(O)c(O)c1)C(O)C(O)COC(=O)c1cc(O)c(O)c(O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeRaphanus sativus Ref.
PlantaeLythraceaePunica granatum Ref.
PlantaePhyllanthaceaePhyllanthus emblica Ref.
zoom in



OrganismRaphanus sativus
Referencehttps://doi.org/10.1016/j.foodres.2014.04.046