input word = C00054205

Metabolite InformationStructural formula
Name Benzoylbutadiyne
Formula C11H6O
Mw 154.04186481
CAS RN 29743-36-0
C_ID C00054205
InChIKey ZKQQJUBGJLUJNT-UHFFFAOYSA-N
InChICode InChI=1S/C11H6O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h1,4-8H
SMILES C#CC#CC(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeChrysanthemum coronarium Ref.
zoom in



OrganismChrysanthemum coronarium
ReferenceBohlmann, F. et al., Chem. Ber., 1963, 96, 226

1964, 97, 1179 (isol, uv, ir, synth)