input word = C00007897

Metabolite InformationStructural formula
Name Okanin 4'-(2'',4'',6''-triacetylglucoside)
Formula C27H28O14
Mw 576.14790561
CAS RN 115070-74-1
C_ID C00007897 ,
InChIKey DUPPPYFIJACNMA-GTQQRCEQNA-N
InChICode InChI=1S/C27H28O14/c1-12(28)37-11-21-25(38-13(2)29)24(36)26(39-14(3)30)27(41-21)40-20-9-6-16(22(34)23(20)35)17(31)7-4-15-5-8-18(32)19(33)10-15/h4-10,21,24-27,32-36H,11H2,1-3H3/b7-4+/t21-,24+,25-,26+,27-/m1/s1
SMILES c1(c(c(c(cc1)C(=O)/C=C/c1cc(c(cc1)O)O)O)O)O[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)OC(=O)C)O)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBidens pilosa Ref.
zoom in



OrganismBidens pilosa
ReferenceHarborne, The Handbook of Natural Flavonoids, 2, (1999), 115,Chalcones,dihydrochalcones and aurones

Hoffmann,Planta Med.,54,(1988),52