input word = C00012096

Metabolite InformationStructural formula
Name Peroxyparthenolide
Formula C15H20O5
Mw 280.13107375
CAS RN 64845-91-6
C_ID C00012096 ,
InChIKey LVTLWUXRARHGCA-QONCTOATNA-N
InChICode InChI=1S/C15H20O5/c1-8-4-5-10-9(2)14(16)18-12(10)13-15(3,19-13)7-6-11(8)20-17/h10-13,17H,1-2,4-7H2,3H3/t10-,11+,12-,13-,15+/m0/s1
SMILES C1C[C@@]2([C@H]([C@@H]3[C@@H](CCC(=C)[C@@H]1OO)C(=C)C(=O)O3)O2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMagnoliaceaeMagnolia grandiflora Ref.
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