input word = C00011777

Metabolite InformationStructural formula
Name [3aR-[3aR*,4R*(2R*,3R*),6E,8S*,10E,11aR*]]-2,3,3a,4,5,8,9,11a-Octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-(hydroxymethyl)-3-methyl-oxiranecarboxylic acid
Formula C20H26O7
Mw 378.16785319
CAS RN 72229-35-7
C_ID C00011777 ,
InChIKey ZKDMWKFVIHFIKW-YALMNZNWNA-N
InChICode InChI=1S/C20H26O7/c1-10-5-14(22)6-11(2)8-16(17-12(3)18(23)25-15(17)7-10)26-19(24)20(9-21)13(4)27-20/h6-7,13-17,21-22H,3,5,8-9H2,1-2,4H3/b10-7-,11-6-/t13-,14+,15-,16-,17+,20-/m1/s1
SMILES O(C(=O)[C@]1([C@H](O1)C)CO)[C@H]1[C@@H]2[C@@H](/C=C(\C[C@@H](/C=C(\C1)/C)O)/C)OC(=O)C2=C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEupatorium mikanioides Ref.
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OrganismEupatorium mikanioides
ReferenceHerz,J. Org. Chem.,45,(1980),489