input word = C00012212

Metabolite InformationStructural formula
Name [10S-(6E,10R*,11aS*)]-3-[(acetyloxy)methyl]-5,8,11,11a-Tetrahydro-6,10-dimethylcyclodeca[b]furan-2,9(4H,10H)-dione
Formula C17H22O5
Mw 306.14672381
CAS RN 128366-60-9
C_ID C00012212 ,
InChIKey SPCAJSVWHVQVEN-HDVYOTRANA-N
InChICode InChI=1S/C17H22O5/c1-10-4-6-13-14(9-21-12(3)18)17(20)22-16(13)8-11(2)15(19)7-5-10/h5,11,16H,4,6-9H2,1-3H3/b10-5+/t11-,16+/m0/s1
SMILES CC(=O)OCC1=C2CC/C(C)=C/CC(=O)[C@@H](C)C[C@H]2OC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAjania achilleoides Ref.
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