Details of Metabolite

General Information of MET (ID: META01192)
Name Dehydrocrepenynic acid
Synonyms   Click to Show/Hide Synonyms of This Metabolite
Dehydrocrepenynic acid; 14,15-Dehydrocrepenynic acid; Crepenynic acid, 14,15-dehydro-; 9,14-Octadecadien-12-ynoic acid, (Z,Z)-; 9,14-Octadecadien-12-ynoic acid, (9Z,14Z)-; SCHEMBL20548399; LMFA01031062
Structure Type   Amino acids, peptides, and analogues  (Click to Show/Hide the Complete Structure Type Hierarchy)
Organic acids and derivatives
Carboxylic acids and derivatives
Amino acids, peptides, and analogues
PubChem CID
14427323
Formula
C18H28O2
Structure
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3D MOL 2D MOL
  Click to Show/Hide the Molecular/Functional Data (External Links/Property/Function) of This Metabolite
Physicochemical Properties Molecular Weight 276.4 Topological Polar Surface Area 37.3
XlogP 5.9 Complexity 352
Heavy Atom Count 20 Rotatable Bond Count 11
Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2
Regulatory Network
Full List of Protein(s) Regulating This Metabolite
      Transcription factor (TF)
            R2R3-MYB (AN2) Click to Show/Hide the Full List of Regulating Pair(s):   1 Pair(s)
               Detailed Information Protein   Info click to show the details of this protein
               Regulating Pair Experim Info click to show the details of experiment for validating this pair [1]
                      Introduced Variation Overexpression of AN2
                      Induced Change Dehydrocrepenynic acid concentration: increase
                      Summary Introduced Variation         Induced Change 
                      Disease Status Healthy individual
                      Details It is reported that overexpression of AN2 leads to the increase of dehydrocrepenynic acid levels compared with control group.
References
1 Comprehensive Influences of Overexpression of a MYB Transcriptor Regulating Anthocyanin Biosynthesis on Transcriptome and Metabolome of Tobacco Leaves. Int J Mol Sci. 2019 Oct 16;20(20):5123.

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