input word = C00012254

Metabolite InformationStructural formula
Name [7R-(7R*,9S*,10E,11aR*)]-9-(Acetyloxy)-3-[(acetyloxy)methyl]-5,6,7,8,9,11a-hexahydro-7-hydroxy-10-methyl-6-methylenecyclodeca[b]furan-2(4H)-one
1beta-Hydroxyafraglaucolide
Formula C19H24O7
Mw 364.15220312
CAS RN 115346-39-9
C_ID C00012254 ,
InChIKey JQLIYZPDZGCDMT-GTRJKIACNA-N
InChICode InChI=1S/C19H24O7/c1-10-5-6-14-15(9-24-12(3)20)19(23)26-18(14)7-11(2)17(8-16(10)22)25-13(4)21/h7,16-18,22H,1,5-6,8-9H2,2-4H3/b11-7+/t16-,17+,18-/m1/s1
SMILES C1(=C)CCC2=C(C(=O)O[C@@H]2/C=C(/[C@H](C[C@H]1O)OC(=O)C)\C)COC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAchillea afra Ref.
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OrganismAchillea afra
ReferenceKhafagy,Phytochem.,27,(1988),1125

Jakupovic,Phytochem.,27,(1988),1129

Abdel-Mogib,Phytochem.,28,(1989),3528