input word = C00057996

Metabolite InformationStructural formula
Name Sphalleroside A
Formula C16H22O8
Mw 342.13146768
CAS RN 192324-34-8
C_ID C00057996
InChIKey PCHIAQZAMZOONE-XYFZXANASA-N
InChICode InChI=1S/C16H22O8/c1-3-4-8-5-9(18)15(22-2)10(6-8)23-16-14(21)13(20)12(19)11(7-17)24-16/h3,5-6,11-14,16-21H,1,4,7H2,2H3/t11-,12-,13+,14-,16-/m1/s1
SMILES C=CCc1cc(O)c(OC)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFoeniculum vulgare Ref.
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