input word = C00001290

Metabolite InformationStructural formula
Name 1-Phenylhepta-1,3,5-triyne
Formula C13H8
Mw 164.06260026
CAS RN 4300-27-0
C_ID C00001290 ,
InChIKey ACKWHAMNCLDPRO-UHFFFAOYSA-N
InChICode InChI=1S/C13H8/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,1H3
SMILES C(
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBidens spp. Ref.
PlantaeAsteraceaeCoreopsis grandiflora Ref.
PlantaeAsteraceaeDahlia spp. Ref.
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OrganismCoreopsis grandiflora
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter8