input word = C00017359

Metabolite InformationStructural formula
Name [4S-(4alpha,4aalpha,5alpha,8aalpha)]-4,4a,5,6,7,8,8a,9-Octahydro-8a-hydroxy-3,4a,5-trimethylnaphtho[2,3-b]furan-4-yl ester 3-methyl-2-butenoic acid
Formula C20H28O4
Mw 332.19875938
CAS RN 54878-41-0
C_ID C00017359 ,
InChIKey MHHDTKFGMDYVQU-CFTDHBCQNA-N
InChICode InChI=1S/C20H28O4/c1-12(2)9-16(21)24-18-17-13(3)11-23-15(17)10-20(22)8-6-7-14(4)19(18,20)5/h9,11,14,18,22H,6-8,10H2,1-5H3/t14-,18+,19-,20-/m0/s1
SMILES CC(C)=CC(=O)O[C@@H]1c2c(C)coc2C[C@@]2(O)CCC[C@H](C)[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeFarfugium japonicum Ref.
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