KEGG   COMPOUND: C00016Help
Entry
C00016                      Compound                               

Name
FAD;
Flavin adenine dinucleotide
Formula
C27H33N9O15P2
Exact mass
785.1571
Mol weight
785.5497
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Reaction
Pathway
Riboflavin metabolism
Metabolic pathways
Vitamin digestion and absorption
Module
M00125  
Riboflavin biosynthesis, GTP => riboflavin/FMN/FAD
Enzyme
1.1.5.3         1.1.5.4         1.1.98.3        1.1.99.2        
1.1.99.3        1.1.99.13       1.1.99.21       1.3.3.6         
1.3.8.1         1.3.8.2         1.3.8.4         1.3.8.6         
1.3.8.7         1.3.8.8         1.3.8.9         1.3.99.1        
1.3.99.-        1.5.1.30        1.5.1.37        1.5.1.45        
1.5.99.3        1.5.-.-         1.6.6.9         1.8.99.2        
1.14.14.7       1.14.14.8       1.14.14.11      1.14.14.15      
1.14.14.-       1.14.99.3       1.17.99.5       2.1.1.74        
2.7.1.180       2.7.7.2         3.6.1.9         3.6.1.18        
4.6.1.15
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  31  Vitamins
   313  Vitamin B preparations
    3131  Vitamin B2 preparations
     D00005  Flavin adenine dinucleotide (JAN)
Risk category of Japanese OTC drugs [BR:br08312]
 Third-class OTC drugs
  Inorganic and organic chemicals
   Flavin adenine dinucleotide
    D00005  Flavin adenine dinucleotide (JAN)
BRITE hierarchy
Other DBs
CAS: 
146-14-5
PubChem: 
ChEBI: 
KNApSAcK: 
PDB-CCD: 
3DMET: 
NIKKAJI: 
KCF data Show

ATOM        53
            1   N4x N    20.7900  -12.8800
            2   C8y C    20.7900  -14.2800
            3   N5x N    21.9800  -14.9800
            4   C8y C    23.2400  -14.2800
            5   C8y C    23.2400  -12.8800
            6   C8y C    21.9800  -12.1800
            7   N4y N    24.4300  -14.9800
            8   C8y C    25.6200  -14.2800
            9   C8y C    25.6200  -12.8800
            10  N5x N    24.4300  -12.1800
            11  C8x C    26.8800  -14.9800
            12  C8y C    28.0700  -14.2800
            13  C8y C    28.0700  -12.8800
            14  C8x C    26.8800  -12.1800
            15  O5x O    21.9800  -10.7800
            16  O5x O    19.6000  -14.9800
            17  C1a C    29.2600  -12.1800
            18  C1a C    29.2600  -14.9800
            19  C1b C    24.4300  -17.2900
            20  C1c C    25.6200  -17.9900
            21  C1c C    26.8100  -17.2900
            22  C1c C    28.0000  -17.9900
            23  C1b C    29.1900  -17.2900
            24  O2b O    30.3800  -17.9900
            25  O1a O    25.6200  -19.3900
            26  O1a O    28.0000  -19.3900
            27  O1a O    26.8100  -15.8900
            28  P1b P    31.7800  -17.9900
            29  O2c O    33.1800  -17.9900
            30  O1c O    31.7800  -16.5900
            31  O1c O    31.7800  -19.3900
            32  P1b P    34.5800  -17.9900
            33  O2b O    35.9800  -17.9900
            34  O1c O    34.5800  -16.5900
            35  O1c O    34.5800  -19.3900
            36  C1y C    38.4300  -17.9900
            37  C1b C    37.2400  -17.2900
            38  C1y C    38.8500  -19.3200
            39  C1y C    40.2500  -19.3200
            40  C1y C    40.6700  -17.9900
            41  O2x O    39.5500  -17.1500
            42  O1a O    38.0100  -20.4400
            43  O1a O    41.0200  -20.5100
            44  N5x N    38.5000  -13.9300
            45  C8x C    38.5000  -15.3300
            46  N5x N    39.6900  -16.0300
            47  C8y C    40.9500  -15.3300
            48  C8y C    40.9500  -13.9300
            49  C8y C    39.6900  -13.2300
            50  N4y N    42.2800  -15.7500
            51  C8x C    43.0500  -14.6300
            52  N5x N    42.2800  -13.5100
            53  N1a N    39.6900  -11.8300
BOND        58
            1     1   2 1
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 2
            12    8  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16    9  14 2
            17    6  15 2
            18    2  16 2
            19   13  17 1
            20   12  18 1
            21    7  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   20  25 1 #Up
            28   22  26 1 #Up
            29   21  27 1 #Down
            30   24  28 1
            31   28  29 1
            32   28  30 2
            33   28  31 1
            34   29  32 1
            35   32  33 1
            36   32  34 2
            37   32  35 1
            38   36  37 1 #Up
            39   33  37 1
            40   36  38 1
            41   38  39 1
            42   39  40 1
            43   40  41 1
            44   36  41 1
            45   38  42 1 #Down
            46   39  43 1 #Down
            47   44  45 2
            48   45  46 1
            49   46  47 2
            50   47  48 1
            51   48  49 2
            52   44  49 1
            53   47  50 1
            54   50  51 1
            55   51  52 2
            56   48  52 1
            57   40  50 1 #Up
            58   49  53 1

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