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 C1CC(=C)[C@]2([C@](C1)(C[C@@H]1[C@H](C2)C(=C)C(=O)O1)CO)OO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEriocephalus africanus Ref.
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