input word = C00049184

Metabolite InformationStructural formula
Name Isofraxinellone
Formula C14H16O3
Mw 232.10994438
CAS RN 92481-63-5
C_ID C00049184 ,
InChIKey CKJJQJLXFWVISP-QTZZOOGMNA-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/h4-5,7-8,11-12H,3,6H2,1-2H3/t11-,12+,14-/m1/s1
SMILES C1=C([C@H]2[C@@](CC1)([C@@H](OC2=O)c1ccoc1)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeDictamnus dasycarpus Ref.
--Fagaropsis glabra Ref.
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