KEGG   COMPOUND: C00376
Entry
C00376                      Compound                               
Name
Retinal;
Vitamin A aldehyde;
Retinene;
all-trans-Retinal;
all-trans-Vitamin A aldehyde;
all-trans-Retinene
Formula
C20H28O
Exact mass
284.214
Mol weight
284.4357
Structure
Reaction
Pathway
map00830  Retinol metabolism
map01100  Metabolic pathways
map01240  Biosynthesis of cofactors
map04744  Phototransduction
map04977  Vitamin digestion and absorption
Enzyme
1.1.1.1         1.1.1.105       1.1.1.300       1.1.1.-         
1.2.1.36        1.2.3.1         1.13.11.63      1.13.11.75
Brite
Lipids [BR:br08002]
 PR  Prenol lipids
  PR01 Isoprenoids
   PR0109 Retinoids
    C00376  Retinal
Other DBs
CAS: 116-31-4
PubChem: 3666
ChEBI: 17898
LIPIDMAPS: LMPR01090002
PDB-CCD: RET[PDBj]
3DMET: B00095
NIKKAJI: J5.279E
KCF data

ATOM        21
            1   C2y C    17.3128  -15.8650
            2   C1z C    17.3128  -17.2822
            3   C2y C    16.0890  -15.1631
            4   C2b C    18.5236  -15.1565
            5   C1x C    16.0890  -17.9970
            6   C1a C    18.5301  -17.9778
            7   C1a C    17.3128  -19.0749
            8   C1x C    14.8716  -15.8650
            9   C1a C    16.0824  -13.7588
            10  C2b C    19.7410  -15.8587
            11  C1x C    14.8716  -17.2822
            12  C2c C    20.9518  -15.1502
            13  C2b C    22.1693  -15.8521
            14  C1a C    20.9518  -13.7524
            15  C2b C    23.3801  -15.1436
            16  C2b C    24.5975  -15.8392
            17  C2c C    25.8020  -15.1244
            18  C2b C    27.0193  -15.8200
            19  C1a C    25.8341  -13.8371
            20  C4a C    28.2173  -15.0407
            21  O4a O    29.4669  -15.6782
BOND        21
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 2
            10    5  11 1
            11   10  12 1
            12   12  13 2
            13   12  14 1
            14   13  15 1
            15   15  16 2
            16   16  17 1
            17   17  18 2
            18   17  19 1
            19   18  20 1
            20   20  21 2
            21    8  11 1

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