input word = C00012240

Metabolite InformationStructural formula
Name [3aS-[3aR*,4R*(Z),5R*,6R*,9S*,10E,11aS*]]-2-Methyl-, 2,3,3a,4,5,6,7,8,9,11a-decahydro-5,6,9-trihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-butenoic acid
Formula C20H26O8
Mw 394.16276781
CAS RN 89355-51-1
C_ID C00012240 ,
InChIKey MEMMEVBUUCPXSU-FEAUBPBGNA-N
InChICode InChI=1S/C20H26O8/c1-6-9(2)18(24)28-16-15-11(4)19(25)27-13(15)7-10(3)12(21)8-14(22)20(5,26)17(16)23/h6-7,12-13,15-17,21,23,26H,4,8H2,1-3,5H3/b9-6+,10-7+/t12-,13+,15+,16-,17+,20-/m0/s1
SMILES [C@H]12[C@H](OC(=O)C1=C)/C=C(/[C@H](CC(=O)[C@]([C@@H]([C@H]2OC(=O)/C(=C/C)/C)O)(C)O)O)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeTrichogonia salviaefolia Ref.
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