input word = C00012925

Metabolite InformationStructural formula
Name [3aR-[3aalpha,4aalpha,5(E),8abeta,9aalpha]]- (2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-8a-methyl-3-methylene-2-oxonaphtho[2,3-b]furan-5-yl)methyl ester 3-phenyl-2-propenoic acid
Cinnamoyloxyisoalloalantolactone
Formula C24H26O4
Mw 378.18310932
CAS RN 119285-35-7
C_ID C00012925 ,
InChIKey KBEBDLGENWRHCO-GIYMFOHMNA-N
InChICode InChI=1S/C24H26O4/c1-16-19-13-20-18(9-6-12-24(20,2)14-21(19)28-23(16)26)15-27-22(25)11-10-17-7-4-3-5-8-17/h3-5,7-11,19-21H,1,6,12-15H2,2H3/b11-10+/t19-,20+,21-,24-/m1/s1
SMILES C=C1C(=O)O[C@@H]2C[C@@]3(C)CCC=C(COC(=O)/C=C/c4ccccc4)[C@@H]3C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAmbrosia artemisioides Ref.
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