input word = C00020949

Metabolite InformationStructural formula
Name Thieleanine
Formula C15H18O3
Mw 246.12559444
CAS RN 71609-03-5
C_ID C00020949 ,
InChIKey WFHQPKSRGIPWQY-XQVAXZBJNA-N
InChICode InChI=1S/C15H18O3/c1-7-4-14-12(9(3)15(17)18-14)5-11-8(2)13(16)6-10(7)11/h6-8,11-12,14H,3-5H2,1-2H3/t7-,8+,11-,12+,14-/m0/s1
SMILES C=C1C(=O)O[C@H]2C[C@H](C)C3=CC(=O)[C@H](C)[C@@H]3C[C@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeDecachaeta thieleana Ref.
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