input word = C00022676

Metabolite InformationStructural formula
Name 14-Hydroxy-5alpha-hydroperoxy-isoalantolactone
Formula C15H20O5
Mw 280.13107375
CAS RN 112823-68-4
C_ID C00022676 ,
InChIKey HYURSACTXJFCCY-FDWLVHDVNA-N
InChICode InChI=1S/C15H20O5/c1-9-4-3-5-14(8-16)7-12-11(6-15(9,14)20-18)10(2)13(17)19-12/h11-12,16,18H,1-8H2/t11-,12-,14-,15-/m1/s1
SMILES C=C1C(=O)O[C@@H]2C[C@@]3(CO)CCCC(=C)[C@]3(OO)C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEriocephalus africanus Ref.
zoom in