input word = C00033835

Metabolite InformationStructural formula
Name Estafiatin 8-O-angelate
Formula C20H24O5
Mw 344.16237388
CAS RN 85758-40-3
C_ID C00033835 ,
InChIKey HIIXAXNQHUSHMG-OARUWZBNNA-N
InChICode InChI=1S/C20H24O5/c1-6-9(2)18(21)23-13-7-10(3)12-8-14-20(5,25-14)16(12)17-15(13)11(4)19(22)24-17/h6,12-17H,3-4,7-8H2,1-2,5H3/b9-6-/t12-,13-,14+,15+,16-,17+,20+/m0/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@@H](OC(=O)/C(C)=CC)CC(=C)[C@@H]1C[C@H]3O[C@@]3(C)[C@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAnthemis melampodina Ref.
zoom in



OrganismAnthemis melampodina
ReferenceStaneva,Phytochem.,69,(2008),607