input word = C00042507

Metabolite InformationStructural formula
Name Eupakirunsin E
(-)-Eupakirunsin E
Formula C20H24O7
Mw 376.15220312
CAS RN 857502-86-4
C_ID C00042507 ,
InChIKey RFSYEWLTJLURJR-SDIWNOIQNA-N
InChICode InChI=1S/C20H24O7/c1-6-9(2)18(22)26-13-8-20(5,24)17-16(27-17)15(21)10(3)7-12-14(13)11(4)19(23)25-12/h6-7,12-14,16-17,24H,4,8H2,1-3,5H3/b9-6+,10-7+/t12-,13+,14-,16?,17+,20+/m0/s1
SMILES [C@@H]12[C@H]([C@](C[C@H]([C@@H]3[C@H](/C=C(/C1=O)\C)OC(=O)C3=C)OC(=O)/C(=C/C)/C)(C)O)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium kiirunense Ref.
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