input word = C00003225

Metabolite InformationStructural formula
Name Bakkenolide A
Formula C15H22O2
Mw 234.16197995
CAS RN 19906-72-0
C_ID C00003225 ,
InChIKey OVXAYHNZXBOVPV-BGNKAUPCNA-N
InChICode InChI=1S/C15H22O2/c1-10-5-4-6-12-7-15(9-14(10,12)3)11(2)8-17-13(15)16/h10,12H,2,4-9H2,1,3H3/t10-,12+,14+,15+/m0/s1
SMILES O1CC(=C)[C@@]2(C1=O)C[C@@H]1[C@](C2)([C@H](CCC1)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCacalia hastata Ref.
PlantaeAsteraceaeHomogyne alpina Ref.
PlantaeAsteraceaeLigularia calthaefolia Ref.
PlantaeAsteraceaePetasites spp. Ref.
PlantaeAsteraceaeSenecio pyramidatus Ref.
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OrganismPetasites spp.
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter51