input word = C00005667

Metabolite InformationStructural formula
Name Spinacetin 7-glucoside
Formula C23H24O13
Mw 508.12169086
CAS RN 60048-89-7
C_ID C00005667 ,
InChIKey FBOPMOBFNZUGSZ-MOKZYHLTNA-N
InChICode InChI=1S/C23H24O13/c1-32-10-5-8(3-4-9(10)25)21-19(30)16(27)14-11(34-21)6-12(22(33-2)17(14)28)35-23-20(31)18(29)15(26)13(7-24)36-23/h3-6,13,15,18,20,23-26,28-31H,7H2,1-2H3/t13-,15-,18+,20+,23-/m1/s1
SMILES COc1cc(-c2oc3cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c(OC)c(O)c3c(=O)c2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCentaurea kotschyi Ref.
PlantaeAsteraceaeCentaurea solstitialis Ref.
PlantaeAsteraceaeClibadium spp. Ref.
PlantaeAsteraceaeLepidophorum repandum Ref.
PlantaeAsteraceaeTetragonotheca ludoviciana Ref.
zoom in