input word = C00011859

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 2-methylbutanoic acid
Formula C20H26O6
Mw 362.17293856
CAS RN 72023-17-7
C_ID C00011859 ,
InChIKey WKWZLJNTIWPTDF-QKMSBMMRNA-N
InChICode InChI=1S/C20H26O6/c1-4-12(2)19(23)25-16-8-14(10-21)6-5-7-15(11-22)9-17-18(16)13(3)20(24)26-17/h6,9-10,12,16-18,22H,3-5,7-8,11H2,1-2H3/b14-6+,15-9-/t12-,16-,17+,18-/m1/s1
SMILES C=C1C(=O)O[C@@H]2/C=C(CO)CC/C=C(/C=O)C[C@@H](OC(=O)C(C)CC)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAcanthospermum hispidum Ref.
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