input word = C00023177

Metabolite InformationStructural formula
Name Eupalinilide A
Formula C20H25ClO7
Mw 412.12888086
CAS RN 757202-06-5
C_ID C00023177 ,
InChIKey IXLMITLRFJSJRS-AMHQEJALNA-N
InChICode InChI=1S/C20H25ClO7/c1-10(5-7-22)17(23)27-13-8-20(26,9-21)12-4-6-19(3,25)15(12)16-14(13)11(2)18(24)28-16/h4-6,12-16,22,25-26H,2,7-9H2,1,3H3/b10-5+/t12-,13+,14+,15-,16+,19-,20-/m0/s1
SMILES [C@]1([C@@H]2[C@@H]([C@H]3[C@@H]([C@@H](C1)OC(=O)/C(=C/CO)/C)C(=C)C(=O)O3)[C@@](C=C2)(C)O)(O)CCl
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium lindleyanum Ref.
zoom in