input word = C00057347

Metabolite InformationStructural formula
Name NSC 349438
Formula C9H12O3
Mw 168.07864425
CAS RN 32954-58-8
C_ID C00057347
InChIKey RJYQLMILDVERHH-UHFFFAOYSA-N
InChICode InChI=1S/C9H12O3/c1-7(10)2-3-9(11)8-4-5-12-6-8/h4-7,10H,2-3H2,1H3
SMILES CC(O)CCC(=O)c1ccoc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiCeratobasidiaceaeCeratocystis fimbriata Ref.
FungiNectriaceaeFusarium solani Ref.
PlantaeConvolvulaceaeIpomoea batatus Ref.
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OrganismCeratocystis fimbriata
ReferenceBoyd, M.R. et al., Biochim. Biophys. Acta, 1974, 337, 184 (isol)