input word = C00008895

Metabolite InformationStructural formula
Name ent-Robinetinidol 3-O-gallate
Formula C22H18O10
Mw 442.0899968
CAS RN 17445-91-9
C_ID C00008895 ,
InChIKey WIEMUOLZHSVGFK-DBHKEIOZNA-N
InChICode InChI=1S/C22H18O10/c23-12-2-1-9-7-18(32-22(30)11-5-15(26)20(29)16(27)6-11)21(31-17(9)8-12)10-3-13(24)19(28)14(25)4-10/h1-6,8,18,21,23-29H,7H2/t18-,21+/m1/s1
SMILES c1(ccc2c(c1)O[C@H]([C@@H](C2)OC(=O)c1cc(c(c(c1)O)O)O)c1cc(c(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeEuphorbia palustris Ref.
PlantaeEuphorbiaceaeEuphorbia stepposa Ref.
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OrganismEuphorbia stepposa
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 355,Flavans and proanthocyanidins

Bondarenko,Chem.Abstr.,76,(1972),121697