input word = C00022566

Metabolite InformationStructural formula
Name 3alpha,4alpha-Epoxy-6-oxo-15,16-epoxy-8beta,10betaH-cis-clerodane-13(16),14-dien-20,12-olide
Formula C20H24O5
Mw 344.16237388
CAS RN 129384-19-6
C_ID C00022566 ,
InChIKey UFHYOYGCHODDKI-NVTUGYRXNA-N
InChICode InChI=1S/C20H24O5/c1-11-8-15(21)18(2)14(4-5-16-19(18,3)25-16)20(11)9-13(24-17(20)22)12-6-7-23-10-12/h6-7,10-11,13-14,16H,4-5,8-9H2,1-3H3/t11-,13-,14+,16-,18-,19-,20-/m1/s1
SMILES C[C@@H]1CC(=O)[C@@]2(C)[C@H](CC[C@H]3O[C@]32C)[C@@]12CC(c1ccoc1)OC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeConyza pyrifolia Ref.
PlantaeAsteraceaePteronia eenii Ref.
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