input word = C00004925

Metabolite InformationStructural formula
Name Pollenitin 8-butyrate
Formula C20H18O8
Mw 386.10016755
CAS RN 69306-83-8
C_ID C00004925 ,
InChIKey CUVUBURTEQFLLZ-UHFFFAOYSA-N
InChICode InChI=1S/C20H18O8/c1-3-4-14(23)27-19-13(26-2)9-12(22)15-16(24)17(25)18(28-20(15)19)10-5-7-11(21)8-6-10/h5-9,21-22,25H,3-4H2,1-2H3
SMILES CCCC(=O)Oc1c(OC)cc(O)c2c(=O)c(O)c(-c3ccc(O)cc3)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePteridaceaeNotholaena aschenborniana Ref.
PlantaePteridaceaeNotholaena sulphurea Ref.
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