input word = C00011860

Metabolite InformationStructural formula
Name (3aR,4R,6E,10Z,11aR)-6-Formyl-2,3,3a,4,5,8,9,11a-octahydro-10-(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 3-methylbutanoic acid
Formula C20H26O6
Mw 362.17293856
CAS RN 72023-18-8
C_ID C00011860 ,
InChIKey XZPCFZLGAZNCOI-QWHLZUBFNA-N
InChICode InChI=1S/C20H26O6/c1-12(2)7-18(23)25-16-8-14(10-21)5-4-6-15(11-22)9-17-19(16)13(3)20(24)26-17/h5,9-10,12,16-17,19,22H,3-4,6-8,11H2,1-2H3/b14-5+,15-9-/t16-,17+,19-/m1/s1
SMILES C\1(=C\CC/C(=C/[C@H]2[C@@H]([C@@H](C1)OC(=O)CC(C)C)C(=C)C(=O)O2)/CO)/C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAcanthospermum hispidum Ref.
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