input word = C00054861

Metabolite InformationStructural formula
Name Acmellonate
Formula C16H24O3
Mw 264.17254463
CAS RN 909001-80-5
C_ID C00054861
InChIKey HSFUFPXSEKRMJH-DEQVHDEQSA-N
InChICode InChI=1S/C16H24O3/c1-4-5-6-7-8-9-10-11-15(17)13-19-16(18)12-14(2)3/h4-7,12H,8-11,13H2,1-3H3/b5-4+,7-6-
SMILES C/C(C)=C/C(OCC(CCCC/C=CC=CC)=O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSpilanthes acmella Ref.
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