input word = C00021379

Metabolite InformationStructural formula
Name Carota-1,4-dienaldehyde
Formula C15H22O
Mw 218.16706532
CAS RN 128718-21-8
C_ID C00021379 ,
InChIKey SZOHSTQGGUHULY-UYWMCZCJNA-N
InChICode InChI=1S/C15H22O/c1-11(2)13-7-9-15(3)8-6-12(10-16)4-5-14(13)15/h5-6,10-11,13H,4,7-9H2,1-3H3/t13-,15+/m1/s1
SMILES [C@@]12(C(=CCC(=CC1)C=O)[C@H](CC2)C(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaeRosa rugosa Ref.
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