input word = C00017313

Metabolite InformationStructural formula
Name [4S-(4alpha,4aalpha,5alpha,6alpha)]-4,4a,5,6,7,9-Hexahydro-6-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-propenoic acid
Formula C19H22O5
Mw 330.14672381
CAS RN 53987-94-3
C_ID C00017313 ,
InChIKey XNFJEQDIJGSDDI-GNGLVIQKNA-N
InChICode InChI=1S/C19H22O5/c1-9(2)18(22)24-17-14-10(3)8-23-16(14)15(21)12-6-7-13(20)11(4)19(12,17)5/h6,8,11,13,17,20H,1,7H2,2-5H3/t11-,13-,17+,19+/m0/s1
SMILES C1[C@@H]([C@@H]([C@@]2(C(=C1)C(=O)c1c([C@H]2OC(=O)C(=C)C)c(co1)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeEuryops spathaceus Ref.
zoom in