input word = C00050739

Metabolite InformationStructural formula
Name 6beta-(2'-Methylbutanoyloxy)-10beta-hydroxy-8beta-methoxyeremophil-7(11)-en-12,8alpha-olide
Formula C21H32O6
Mw 380.21988875
CAS RN 587833-65-6
C_ID C00050739
InChIKey UDVLOCQBYDZUGP-GHEQNQDWNA-N
InChICode InChI=1S/C21H32O6/c1-7-12(2)17(22)26-16-15-14(4)18(23)27-21(15,25-6)11-20(24)10-8-9-13(3)19(16,20)5/h12-13,16,24H,7-11H2,1-6H3/t12?,13-,16+,19-,20-,21-/m0/s1
SMILES CCC(C)C(=O)O[C@@H]1C2=C(C)C(=O)O[C@@]2(OC)C[C@@]2(O)CCC[C@H](C)[C@@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLigularia sagitta Ref.
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