KEGG   COMPOUND: C01607Help
Entry
C01607                      Compound                               

Name
Phytanate;
Phytanic acid;
3,7,11,15-Tetramethylhexadecanoic acid
Formula
C20H40O2
Exact mass
312.3028
Mol weight
312.5304
Structure
Mol fileKCF fileDB searchJmolKegDraw
Reaction
Enzyme
Brite
Lipids [BR:br08002]
 PR  Prenol Lipids
  PR01 Isoprenoids
   PR0104 C20 isoprenoids (diterpenes)
    PR010401 Acyclic diterpenoids
     C01607  Phytanate
Target-based classification of compounds [BR:br08010]
 Nuclear receptors
  Thyroid hormone like receptors
   Peroxisome proliferator-activated receptor
    nuclear receptor, subfamily 1, group C, member 1
     C01607  Phytanate
  Hepatocyte nuclear factor 4 like receptors
   Retinoid X receptor (RXR)
    retinoid receptor
     C01607  Phytanate
BRITE hierarchy
Other DBs
CAS: 
14721-66-5
PubChem: 
ChEBI: 
LIPIDMAPS: 
NIKKAJI: 
KCF data Show

ATOM        22
            1   C1b C    29.2826  -34.2784
            2   C1c C    28.0724  -33.5768
            3   C1b C    30.4869  -33.5768
            4   C1b C    26.8622  -34.2784
            5   C1a C    28.0724  -32.1736
            6   C1b C    31.7088  -34.2784
            7   C1b C    25.6462  -33.5768
            8   C1c C    32.9191  -33.5768
            9   C1b C    24.4417  -34.2784
            10  C1b C    34.1293  -34.2608
            11  C1a C    32.9191  -32.1736
            12  C1c C    23.2257  -33.5768
            13  C6a C    35.3044  -33.5008
            14  C1b C    22.0155  -34.2784
            15  C1a C    23.2257  -32.1736
            16  O6a O    36.5498  -34.1497
            17  O6a O    35.3102  -32.1094
            18  C1b C    20.8052  -33.5768
            19  C1b C    19.5891  -34.2784
            20  C1c C    18.3848  -33.5768
            21  C1a C    17.1688  -34.2784
            22  C1a C    18.3848  -32.1736
BOND        21
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     6   8 1
            8     7   9 1
            9     8  10 1
            10    8  11 1
            11    9  12 1
            12   10  13 1
            13   12  14 1
            14   12  15 1
            15   13  16 1
            16   13  17 2
            17   14  18 1
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   20  22 1

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