input word = C00044067

Metabolite InformationStructural formula
Name 5'-epi-Isoethuliacoumarin B
(+)-5'-epi-Isoethuliacoumarin B
Formula C20H22O5
Mw 342.14672381
CAS RN 212266-09-6
C_ID C00044067 ,
InChIKey WEPZBXOVWNYLTR-KFCOIAHNNA-N
InChICode InChI=1S/C20H22O5/c1-6-19(5)10-20(17(22)18(3,4)25-20)24-15-13-11(2)8-7-9-12(13)23-16(21)14(15)19/h6-9,17,22H,1,10H2,2-5H3/t17-,19+,20-/m1/s1
SMILES C=C[C@@]1(C)C[C@@]2(Oc3c1c(=O)oc1cccc(C)c31)OC(C)(C)[C@H]2O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEthulia conyzoides Ref.
zoom in