input word = C00017365

Metabolite InformationStructural formula
Name [4aS-[4aalpha,5alpha,6beta(E),8abeta]]-3-methyl-, 4,4a,5,6,7,8,8a,9-Octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-6-yl ester 2-pentenoic acid
Formula C21H30O3
Mw 330.21949482
CAS RN 59742-05-1
C_ID C00017365 ,
InChIKey OCOYHOXMCJVVSI-NGTKOAFVNA-N
InChICode InChI=1S/C21H30O3/c1-6-13(2)9-20(22)24-18-8-7-16-10-19-17(14(3)12-23-19)11-21(16,5)15(18)4/h9,12,15-16,18H,6-8,10-11H2,1-5H3/b13-9+/t15-,16-,18+,21-/m0/s1
SMILES CC/C(C)=C/C(=O)O[C@@H]1CC[C@H]2Cc3occ(C)c3C[C@]2(C)[C@H]1C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio praecox Ref.
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