input word = C00031771

Metabolite InformationStructural formula
Name Erigerenone B
Formula C12H18O4
Mw 226.12050906
CAS RN 640290-99-9
C_ID C00031771 ,
InChIKey NFRUZLCRXIYQPR-MDWBIBFBNA-N
InChICode InChI=1S/C12H18O4/c1-4-5-8-9(6-12(14)16-3)10(13)7-11(8)15-2/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
SMILES C1(=O)C=C([C@@H]([C@H]1CC(=O)OC)CCC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeErigeron philadelphicus L. Ref.
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