input word = C00023181

Metabolite InformationStructural formula
Name Eupalinilide E
Formula C20H25ClO6
Mw 396.13396624
CAS RN 757202-17-8
C_ID C00023181 ,
InChIKey RQLHOJWFBMNYHW-UIBNWKHANA-N
InChICode InChI=1S/C20H25ClO6/c1-5-9(2)18(23)26-13-7-20(25,8-21)16-12(22)6-10(3)14(16)17-15(13)11(4)19(24)27-17/h5-6,12-17,22,25H,4,7-8H2,1-3H3/b9-5+/t12-,13+,14-,15+,16+,17-,20-/m0/s1
SMILES C=C1C(=O)O[C@@H]2[C@H]3C(C)=C[C@@H](O)[C@H]3[C@@](O)(CCl)C[C@@H](OC(=O)/C(C)=C/C)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium lindleyanum Ref.
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OrganismEupatorium lindleyanum
ReferenceHuo,J. Nat. Prod.,67,(2004),1470