input word = C00042039

Metabolite InformationStructural formula
Name 11,13-Epoxy-3-ketodehydrocostus-lactone
Formula C15H16O4
Mw 260.104859
CAS RN 205492-13-3
C_ID C00042039 ,
InChIKey DJGLGXXXPMRUCU-NBAGAYNZNA-N
InChICode InChI=1S/C15H16O4/c1-7-3-4-10-13(19-14(17)15(10)6-18-15)12-8(2)11(16)5-9(7)12/h9-10,12-13H,1-6H2/t9-,10+,12-,13-,15-/m0/s1
SMILES [C@H]12[C@@H](CCC(=C)[C@H]3[C@@H]1C(=C)C(=O)C3)[C@]1(C(=O)O2)CO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSaussurea lappa Ref.
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