input word = C00017418

Metabolite InformationStructural formula
Name [4S-(4alpha,4aalpha,5alpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 3-methyl-2-butenoic acid
Formula C20H26O4
Mw 330.18310932
CAS RN 59742-08-4
C_ID C00017418 ,
InChIKey OKMDXLNHYGVDON-FSXZITTHNA-N
InChICode InChI=1S/C20H26O4/c1-11(2)9-15(21)24-19-16-12(3)10-23-18(16)17(22)14-8-6-7-13(4)20(14,19)5/h9-10,13-14,19H,6-8H2,1-5H3/t13-,14-,19+,20+/m0/s1
SMILES CC(C)=CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@H]2CCC[C@H](C)[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio praecox Ref.
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