input word = C00045156

Metabolite InformationStructural formula
Name 15-Isovaleroyloxycostunolide
Formula C20H28O4
Mw 332.19875938
CAS RN 67667-69-0
C_ID C00045156 ,
InChIKey DCBNPSQJFILSPX-DIJBWKFRNA-N
InChICode InChI=1S/C20H28O4/c1-13(2)10-19(21)23-12-16-7-5-6-14(3)8-9-17-15(4)20(22)24-18(17)11-16/h6,11,13,17-18H,4-5,7-10,12H2,1-3H3/b14-6-,16-11+/t17-,18-/m0/s1
SMILES C=C1C(=O)O[C@@H]2/C=C(COC(=O)CC(C)C)CC/C=C(/C)CC[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCosmos pringlei Ref.
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