input word = C00060800

Metabolite InformationStructural formula
Name 1,5,8-Trimethyltetraline
Formula C13H18
Mw 174.14085057
CAS RN 21693-51-6
C_ID C00060800
InChIKey OIIJXQMSEYQDDI-UHFFFAOYSA-N
InChICode InChI=1S/C13H18/c1-9-7-8-11(3)13-10(2)5-4-6-12(9)13/h7-8,10H,4-6H2,1-3H3
SMILES Cc1ccc(C)c2c1CCCC2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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OrganismNicotiana tabacum
Referencehttps://doi.org/10.1016/j.chroma.2004.03.057