input word = C00000229

Metabolite InformationStructural formula
Name 3-Oxo-2-(2Z-Pentenyl)cyclopentyl propionic acid
Formula C13H20O3
Mw 224.1412445
CAS RN 197794-71-1
C_ID C00000229 ,
InChIKey UEAQWDUMMDCPBH-NTPZQRLJNA-N
InChICode InChI=1S/C13H20O3/c1-2-3-4-5-11-10(6-8-12(11)14)7-9-13(15)16/h3-4,10-11H,2,5-9H2,1H3,(H,15,16)/b4-3-/t10-,11+/m1/s1
SMILES C1C[C@@H]([C@@H](C1=O)C/C=C\CC)CCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiIncertae sedisBotryodiplodia theobromae Ref.
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