input word = C00011680

Metabolite InformationStructural formula
Name [S-[R*,S*-(E)]]-2-Methyl-6-(4-methyl-2-oxo-3-cyclohexen-1-yl)-2-heptenal
Formula C15H22O2
Mw 234.16197995
CAS RN 81053-37-4
C_ID C00011680 ,
InChIKey CNPHVDOJCOUUFU-DGXYMCFCNA-N
InChICode InChI=1S/C15H22O2/c1-11-7-8-14(15(17)9-11)13(3)6-4-5-12(2)10-16/h5,9-10,13-14H,4,6-8H2,1-3H3/b12-5+/t13-,14+/m1/s1
SMILES C1C[C@H](C(=O)C=C1C)[C@@H](CC/C=C(\C)/C=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio smithii Ref.
zoom in