KEGG   DRUG: D00005Help
Entry
D00005                      Drug                                   

Name
Flavin adenine dinucleotide (JAN);
Adeflavin (TN)
Formula
C27H33N9O15P2
Exact mass
785.1571
Mol weight
785.5497
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Same as: 
Therapeutic category: 
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)
BRITE hierarchy
Other DBs
CAS: 
146-14-5
PubChem: 
DrugBank: 
LigandBox: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        53
            1   N4x N     5.3900   -8.0500
            2   C8y C     5.3900   -9.4500
            3   N5x N     6.6024  -10.1500
            4   C8y C     7.8149   -9.4500
            5   C8y C     7.8149   -8.0500
            6   C8y C     6.6024   -7.3500
            7   N4y N     9.0273  -10.1500
            8   C8y C    10.2397   -9.4500
            9   C8y C    10.2397   -8.0500
            10  N5x N     9.0273   -7.3500
            11  C8x C    11.4522  -10.1500
            12  C8y C    12.6646   -9.4500
            13  C8y C    12.6646   -8.0500
            14  C8x C    11.4522   -7.3500
            15  O5x O     6.6024   -5.9502
            16  O5x O     4.1776  -10.1500
            17  C1a C    13.8811   -7.3477
            18  C1a C    13.8811  -10.1523
            19  C1b C     9.0273  -12.4600
            20  C1c C    10.2418  -13.1612
            21  C1c C    11.4383  -12.4702
            22  C1c C    12.6251  -13.1554
            23  C1b C    13.8166  -12.4672
            24  O2b O    15.0060  -13.1539
            25  O1a O    10.2418  -14.5598
            26  O1a O    12.6253  -14.5598
            27  O1a O    11.4384  -11.0603
            28  P1b P    16.4060  -13.1539
            29  O2c O    17.8060  -13.1539
            30  O1c O    16.4060  -11.7539
            31  O1c O    16.4060  -14.5539
            32  P1b P    19.2060  -13.1539
            33  O2b O    20.6060  -13.1539
            34  O1c O    19.2059  -11.7602
            35  O1c O    19.2061  -14.5598
            36  C1y C    23.0309  -13.1539
            37  C1b C    21.8184  -12.4539
            38  C1y C    23.4423  -14.4920
            39  C1y C    24.8422  -14.5139
            40  C1y C    25.2956  -13.1894
            41  O2x O    24.1761  -12.3488
            42  O1a O    22.6054  -15.6065
            43  O1a O    25.6386  -15.6468
            44  N5x N    23.1000   -9.1000
            45  C8x C    23.1000  -10.5000
            46  N5x N    24.3124  -11.2000
            47  C8y C    25.5249  -10.5000
            48  C8y C    25.5249   -9.1000
            49  C8y C    24.3124   -8.4000
            50  N4y N    26.8564  -10.9326
            51  C8x C    27.6793   -9.8000
            52  N5x N    26.8564   -8.6674
            53  N1a N    24.3124   -7.0002
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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