input word = C00045863

Metabolite InformationStructural formula
Name Disparfuran B
Formula C22H18O5
Mw 362.11542369
CAS RN 342389-77-9
C_ID C00045863 ,
InChIKey JAUBTGXMJPQEII-UHFFFAOYNA-N
InChICode InChI=1S/C22H18O5/c1-3-12(2)19(24)18-20(25)17-15(13-7-5-4-6-8-13)11-16(23)27-22(17)14-9-10-26-21(14)18/h4-12,25H,3H2,1-2H3/t12-/m1/s1
SMILES CCC(C)C(=O)c1c(O)c2c(-c3ccccc3)cc(=O)oc2c2ccoc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCalophyllaceae/Clusiaceae/Clusiaceae-GuttiferaeCalophyllum dispar Ref.
zoom in