input word = C00012251

Metabolite InformationStructural formula
Name [9S-(9R*,10E,11aS*)]- 5,6,9,11a-Tetrahydro-9-hydroxy-3-(hydroxymethyl)-10-methyl-6-methylenecyclodeca[b]furan-2,7(4H,8H)-dione
1,13-Bis-O-desacetyl-1-oxoafraglaucolide
Formula C15H18O5
Mw 278.11542369
CAS RN 126025-04-5
C_ID C00012251 ,
InChIKey DLMKPBDNRSJGBM-SLKHZRMSNA-N
InChICode InChI=1S/C15H18O5/c1-8-3-4-10-11(7-16)15(19)20-14(10)5-9(2)13(18)6-12(8)17/h5,13-14,16,18H,1,3-4,6-7H2,2H3/b9-5+/t13-,14+/m0/s1
SMILES C1(=C)CCC2=C(C(=O)O[C@@H]2/C=C(/[C@H](CC1=O)O)\C)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAchillea fragrantissima Ref.
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