input word = C00017342

Metabolite InformationStructural formula
Name [4aS-[4aalpha,5alpha,6beta,7alpha(Z),8abeta]]- 6-(Acetyloxy)-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-7-yl ester 2-methyl-2-butenoic acid
Formula C22H30O5
Mw 374.20932407
CAS RN 54878-89-6
C_ID C00017342 ,
InChIKey QGJOZBRXAVBQQO-RPSPSNISNA-N
InChICode InChI=1S/C22H30O5/c1-7-12(2)21(24)27-19-9-16-8-18-17(13(3)11-25-18)10-22(16,6)14(4)20(19)26-15(5)23/h7,11,14,16,19-20H,8-10H2,1-6H3/b12-7-/t14-,16+,19-,20-,22-/m0/s1
SMILES C/C=C(/C)C(=O)O[C@H]1C[C@H]2Cc3occ(C)c3C[C@]2(C)[C@@H](C)[C@@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeOthonna spp. Ref.
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