input word = C00044545

Metabolite InformationStructural formula
Name Aspergione A
(+)-Aspergione A
Formula C16H18O4
Mw 274.12050906
CAS RN 344361-77-9
C_ID C00044545 ,
InChIKey KNTFURPASNMXEY-UHFFFAOYNA-N
InChICode InChI=1S/C16H18O4/c1-8-7-11-5-6-12-14(17)9(2)10(3)20-15(12)13(11)16(18-4)19-8/h5-6,8,16H,7H2,1-4H3/t8-,16-/m0/s1
SMILES COC1OC(C)Cc2ccc3c(=O)c(C)c(C)oc3c21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus versicolor Ref.
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