input word = C00023188

Metabolite InformationStructural formula
Name Eupachinilide E
Formula C20H25ClO8
Mw 428.12379549
CAS RN 691851-94-2
C_ID C00023188 ,
InChIKey JNLCQVGOEVZPLZ-OQNQNEJRNA-N
InChICode InChI=1S/C20H25ClO8/c1-8(4-5-22)17(24)27-10-6-20(26,7-21)12-13(19(3)16(29-19)14(12)23)15-11(10)9(2)18(25)28-15/h4,10-16,22-23,26H,2,5-7H2,1,3H3/b8-4+/t10-,11-,12+,13+,14+,15-,16-,19+,20+/m1/s1
SMILES C=C1C(=O)O[C@H]2[C@H]1[C@H](OC(=O)/C(C)=C/CO)C[C@](O)(CCl)[C@@H]1[C@H](O)[C@H]3O[C@@]3(C)[C@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium chinense Ref.
PlantaeAsteraceaeEupatorium lindleyanum Ref.
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OrganismEupatorium lindleyanum
ReferenceHuo,J. Nat. Prod.,67,(2004),1470