input word = C00054204

Metabolite InformationStructural formula
Name Benzyldiacetylene
Formula C11H8
Mw 140.06260026
CAS RN 41268-41-1
C_ID C00054204
InChIKey ZZGANZXITREHOP-UHFFFAOYSA-N
InChICode InChI=1S/C11H8/c1-2-3-5-8-11-9-6-4-7-10-11/h1,4,6-7,9-10H,8H2
SMILES C#CC#CCc1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia dracunculus Ref.
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OrganismArtemisia dracunculus
ReferenceBohlmann, F. et al., Chem. Ber., 1962, 95, 39

1963, 96, 226 (isol, uv, ir, struct)