Met005235: trans,trans-2,4-Heptadienal
Metabolite Information
Name
trans,trans-2,4-Heptadienal
IUPAC Name
(2E,4E)-hepta-2,4-dienal
Molecular Formula
C7H10O
Molecular Weight
110.15
Exact Mass
110.0731649
SMILES
CCC=CC=CC=O
InChIKey
SATICYYAWWYRAM-VNKDHWASSA-N
InChI
InChI=1S/C7H10O/c1-2-3-4-5-6-7-8/h3-7H,2H2,1H3/b4-3+,6-5+
Other Databases Link
Structure
2D Structure
3D Structure
Classification
(data sourced from ClassyFire)
Kingdom:
Organic compounds
Superclass:
Organic oxygen compounds
Class:
Organooxygen compounds
Subclass:
Carbonyl compounds
Crops containing this metabolite
astragalus
leonurus
leonurus
Metabolite Spectrum Accession Label