input word = C00020225

Metabolite InformationStructural formula
Name 9-Oxo-12-hydroxy-10,11-dehydroageraphorone
Formula C15H20O3
Mw 248.1412445
CAS RN 79491-72-8
C_ID C00020225 ,
InChIKey TYBMHGBQRJQXQU-QWBYWMBENA-N
InChICode InChI=1S/C15H20O3/c1-8-5-14(18)15(10(3)7-16)12-4-9(2)13(17)6-11(8)12/h4,8,11-12,16H,5-7H2,1-3H3/b15-10-/t8-,11+,12-/m0/s1
SMILES C1(=O)C(=C[C@H]2[C@H](C1)[C@H](CC(=O)/C/2=C(\CO)/C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAgeratina adenophora Ref.
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