input word = C00053908

Metabolite InformationStructural formula
Name Xylomolone D
Formula C12H18O4
Mw 226.12050906
CAS RN 2337077-64-0
C_ID C00053908
InChIKey QVSZWISJXKFXSJ-MRVPVSSYSA-N
InChICode InChI=1S/C12H18O4/c1-7-8(5-10(14)16-4)12(2,3)6-9(13)11(7)15/h8,15H,5-6H2,1-4H3/t8-/m1/s1
SMILES OC1=C(C)[C@@H](CC(OC)=O)C(C)(C)CC1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMeliaceaeXylocarpus moluccensis Ref.
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