input word = C00061037

Metabolite InformationStructural formula
Name (-)-Theaspirone A
Formula C13H20O2
Mw 208.14632988
CAS RN 24399-19-7
C_ID C00061037
InChIKey AXQMCYYCOKLZPP-GXFFZTMASA-N
InChICode InChI=1S/C13H20O2/c1-9-7-11(14)8-12(3,4)13(9)6-5-10(2)15-13/h7,10H,5-6,8H2,1-4H3/t10-,13+/m0/s1
SMILES CC1=CC(=O)CC(C)(C)C12CCC(C)O2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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