input word = C00003280

Metabolite InformationStructural formula
Name 10-epi-Eupatoroxin
Formula C20H24O8
Mw 392.14711774
CAS RN 20071-54-9
C_ID C00003280 ,
InChIKey QUSNLLJZMPVTTC-BCJYXJLKNA-N
InChICode InChI=1S/C20H24O8/c1-5-8(2)16(22)26-10-6-19(7-25-19)13-12(21)15-18(4,28-15)20(13,24)14-11(10)9(3)17(23)27-14/h5,10-15,21,24H,3,6-7H2,1-2,4H3/b8-5-/t10-,11-,12+,13+,14+,15-,18-,19-,20-/m1/s1
SMILES [C@@H]12[C@@]([C@@H]3[C@@H]([C@@H](C[C@@]41OC4)OC(=O)/C(=C\C)/C)C(=C)C(=O)O3)([C@]1([C@@H]([C@H]2O)O1)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium rotundifolium Ref.
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