Details of Metabolite

General Information of MET (ID: META01194)
Name 2,6-Dimethylhept-2-enedioic acid
Synonyms   Click to Show/Hide Synonyms of This Metabolite
(E,4E,6S)-6-Amino-4-[2-[(2R)-6-hydroxy-2,5-dimethyl-2,3-dihydroindol-1-ium-1-ylidene]ethylidene]-2,6-dimethylhept-2-enedioic acid
Structure Type   Fatty acids and conjugates  (Click to Show/Hide the Complete Structure Type Hierarchy)
Lipids and lipid-like molecules
Fatty Acyls
Fatty acids and conjugates
PubChem CID
148298944
Formula
C21H27N2O5+
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 387.4 Topological Polar Surface Area 124
XlogP -0.4 Complexity 726
Heavy Atom Count 28 Rotatable Bond Count 6
Hydrogen Bond Donor Count 4 Hydrogen Bond Acceptor Count 6
Regulatory Network
Full List of Protein(s) Regulating This Metabolite
      Transferases (EC 2)
            Squalene synthase (FDFT1) 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 Mutation of FDFT1
                      Induced Change 2,6-Dimethylhept-2-enedioic acid concentration: increase
                      Summary Introduced Variation         Induced Change 
                      Disease Status Lipid metabolism disorders [ICD-11: 5C52]
                      Details It is reported that mutation (patients with variants in FDFT1) of FDFT1 leads to the increase of 2,6-dimethylhept-2-enedioic acid levels compared with control group.
References
1 Squalene Synthase Deficiency.

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