input word = C00017352

Metabolite InformationStructural formula
Name [4S-[4alpha,4aalpha,5alpha,6alpha(Z),8aalpha]]-4-(Acetyloxy)-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-6-yl ester 2-methyl-2-butenoic acid
Formula C22H30O5
Mw 374.20932407
CAS RN 54911-13-6
C_ID C00017352 ,
InChIKey LJMVPNYZXHUHTL-YSYHUXJXNA-N
InChICode InChI=1S/C22H30O5/c1-7-12(2)21(24)27-17-9-8-16-10-18-19(13(3)11-25-18)20(26-15(5)23)22(16,6)14(17)4/h7,11,14,16-17,20H,8-10H2,1-6H3/b12-7-/t14-,16+,17-,20+,22-/m0/s1
SMILES C1[C@@H]([C@@H]([C@]2([C@H](C1)Cc1c([C@H]2OC(=O)C)c(co1)C)C)C)OC(=O)/C(=C\C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeOthonna spp. Ref.
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