input word = C00050519

Metabolite InformationStructural formula
Name 4,7-Dimethyl-1-tetralone
Formula C12H14O
Mw 174.10446507
CAS RN 28449-86-7
C_ID C00050519
InChIKey SQESYXTWWGWCFK-UHFFFAOYSA-N
InChICode InChI=1S/C12H14O/c1-8-3-5-10-9(2)4-6-12(13)11(10)7-8/h3,5,7,9H,4,6H2,1-2H3
SMILES Cc1ccc2c(c1)C(=O)CCC2C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCyperaceaeCyperus rotundus Ref.
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OrganismCyperus rotundus
ReferenceThebtaranonth, et al., Phytochemistry, 40, (1995), 125.

Chen, et al., Lexicon of Active Componentsin in Plants, Vol1, Medicinal Science and Technology Press of China, Beijing, (2001).