input word = C00012924

Metabolite InformationStructural formula
Name [3aR-(3aalpha,4aalpha,8abeta,9aalpha)]- 5-[(Acetyloxy)methyl]-3a,4,4a,7,8,8a,9,9a-octahydro-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
15-Acetoxyisoalloalantolactone
Formula C17H22O4
Mw 290.15180919
CAS RN 119285-34-6
C_ID C00012924 ,
InChIKey CIMPZVDZLDTMRO-CNSJDJIMNA-N
InChICode InChI=1S/C17H22O4/c1-10-13-7-14-12(9-20-11(2)18)5-4-6-17(14,3)8-15(13)21-16(10)19/h5,13-15H,1,4,6-9H2,2-3H3/t13-,14+,15-,17-/m1/s1
SMILES C=C1C(=O)O[C@@H]2C[C@@]3(C)CCC=C(COC(C)=O)[C@@H]3C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAmbrosia artemisioides Ref.
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