input word = C00054495

Metabolite InformationStructural formula
Name 1,3-Benzodioxole-5-pentanoic acid
Formula C12H14O4
Mw 222.08920894
CAS RN 41917-45-7
C_ID C00054495
InChIKey VSLFLWQBWGEPBW-UHFFFAOYSA-N
InChICode InChI=1S/C12H14O4/c13-12(14)4-2-1-3-9-5-6-10-11(7-9)16-8-15-10/h5-7H,1-4,8H2,(H,13,14)
SMILES O=C(O)CCCCC1=CC2=C(OCO2)C=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePiperaceaePiper longum Ref.
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