input word = C00042155

Metabolite InformationStructural formula
Name 5-Methylmellein
Formula C11H12O3
Mw 192.07864425
CAS RN 7734-92-1
C_ID C00042155 ,
InChIKey YETSBBYQOFXYGV-JLDDOWRYNA-N
InChICode InChI=1S/C11H12O3/c1-6-3-4-9(12)10-8(6)5-7(2)14-11(10)13/h3-4,7,12H,5H2,1-2H3/t7-/m1/s1
SMILES c12c(c(ccc1C)O)C(=O)O[C@@H](C2)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiXylariaceaeBiscogniauxia mediterranea Ref.
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