input word = C00011939

Metabolite InformationStructural formula
Name Fraxinellone
Formula C14H16O3
Mw 232.10994438
CAS RN 28808-62-0
C_ID C00011939 ,
InChIKey XYYAFLHHHZVPRN-XGJSPVFONA-N
InChICode InChI=1S/C14H16O3/c1-9-4-3-6-14(2)11(9)13(15)17-12(14)10-5-7-16-8-10/h5,7-8,12H,3-4,6H2,1-2H3/t12-,14+/m0/s1
SMILES C1[C@@]2(C(=C(CC1)C)C(=O)O[C@H]2c1ccoc1)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeMelia azedarach Ref.
PlantaeRutaceaeDictamnus albus L. Ref.
PlantaeRutaceaeDictamnus angustifolius Ref.
PlantaeRutaceaeDictamnus dasycarpus Ref.
PlantaeRutaceaeDictamnus radicis Cortex Ref.
--Dictamus albus Ref.
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OrganismDictamnus radicis Cortex
ReferenceZhao,Chem.Pharm.Bull.,56,(2008),102