KEGG   DRUG: Hydroxocobalamin acetate
Entry
D02707                      Drug                                   

Name
Hydroxocobalamin acetate (JP18);
Docelan (TN)
Product
  Generic
Formula
C64H91CoN13O16P
Exact mass
1387.5776
Mol weight
1388.3918
Structure
Simcomp
Remark
Therapeutic category: 3136
ATC code: B03BA03 V03AB33
Chemical structure group: DG00175
Product (DG00175): D01027<US> D02707<JP/US>
Product (mixture): D04904<JP> D04919<JP> D08829<JP>
Efficacy
Anti-anemic, Hematopoietic, Supplement (vitamin B12)
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 B BLOOD AND BLOOD FORMING ORGANS
  B03 ANTIANEMIC PREPARATIONS
   B03B VITAMIN B12 AND FOLIC ACID
    B03BA Vitamin B12 (cyanocobalamin and analogues)
     B03BA03 Hydroxocobalamin
      D02707  Hydroxocobalamin acetate (JP18) <JP/US>
 V VARIOUS
  V03 ALL OTHER THERAPEUTIC PRODUCTS
   V03A ALL OTHER THERAPEUTIC PRODUCTS
    V03AB Antidotes
     V03AB33 Hydroxocobalamin
      D02707  Hydroxocobalamin acetate (JP18) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 3  Agents affecting metabolism
  31  Vitamins
   313  Vitamin B preparations
    3136  Vitamin B12 preparations
     D02707  Hydroxocobalamin acetate (JP18)
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D02707  Hydroxocobalamin acetate
Other DBs
CAS: 22465-48-1
PubChem: 17396874
DrugBank: DB00200
NIKKAJI: J2.210.588D
LinkDB
KCF data

ATOM        95
            1   O7a O     4.2695   -5.8004
            2   C7a C     4.9820   -5.3879
            3   C1a C     5.6945   -5.8004
            4   C1y C     3.5374  -10.1629
            5   C1z C     3.5374   -8.7458
            6   C1y C     3.1905  -10.8497
            7   N1y N     4.2967  -10.2749
            8   C1z C     3.1905   -8.0445
            9   N2x N     4.3078   -8.6228
            10  C1a C     2.7857   -8.9448
            11  C1z C     3.7474  -11.3956
            12  C1b C     2.3448  -10.8462
            13  C2y C     4.4307  -11.0342
            14  Z   Co    5.0056   -9.3932 #+
            15  C1y C     3.7474   -7.5022
            16  C1b C     2.4208   -8.0301
            17  C1a C     2.9880   -7.2962
            18  C2y C     4.4376   -7.8677
            19  C1b C     3.7398  -12.1694
            20  C1a C     4.4811  -11.5911
            21  C5a C     2.0698  -11.5732
            22  C2y C     5.1355  -11.3126
            23  C1b C     3.7585   -6.7283
            24  C5a C     2.0339   -7.3757
            25  C2y C     5.1355   -7.5961
            26  C1b C     3.0607  -12.5633
            27  N1a N     1.3105  -11.6961
            28  O5a O     2.5542  -12.1659
            29  C2y C     5.8333  -11.0128
            30  C1a C     5.1320  -12.0823
            31  C1b C     3.0931   -6.3345
            32  N1a N     1.2711   -7.3647
            33  O5a O     2.4311   -6.7034
            34  C2y C     5.8299   -7.8857
            35  C1a C     5.1320   -6.8154
            36  C5a C     3.0530  -13.3336
            37  C1y C     6.5056  -11.3776
            38  N2x N     5.9708  -10.2603
            39  C5a C     3.1034   -5.5839
            40  C1z C     6.5022   -7.5098
            41  N2x N     5.9811   -8.6518
            42  N1b N     2.3918  -13.7164
            43  O5a O     3.7219  -13.7309
            44  C1z C     7.0770  -10.8497
            45  C1b C     6.5850  -12.1625
            46  C2y C     6.7440  -10.1629
            47  N1a N     2.4388   -5.1853
            48  O5a O     3.7764   -5.2049
            49  C1y C     7.0694   -8.0121
            50  C1b C     6.4945   -6.7180
            51  C1a C     5.7462   -7.3031
            52  C2y C     6.7661   -8.7168
            53  C1b C     2.3918  -14.5116
            54  C1a C     7.8219  -10.6473
            55  C1a C     7.3624  -11.5876
            56  C1b C     7.2940  -12.4693
            57  C2x C     7.0480   -9.4361
            58  C1b C     7.8432   -8.0010
            59  C5a C     7.1634   -6.3165
            60  C1c C     1.6863  -14.9165
            61  C5a C     7.3624  -13.2397
            62  C1b C     8.2336   -7.3322
            63  N1a N     7.1565   -5.5685
            64  O5a O     7.8322   -6.7180
            65  O2b O     1.6863  -15.7305
            66  C1a C     0.9927  -14.5193
            67  N1a N     6.7336  -13.6839
            68  O5a O     8.0781  -13.5685
            69  C5a C     8.9999   -7.3288
            70  P1b P     0.9781  -16.1388
            71  N1a N     9.3867   -6.6599
            72  O5a O     9.4013   -8.0010
            73  O2b O     1.8315  -16.5147
            74  O1c O     0.4033  -16.7137
            75  O1c O     0.2658  -15.7305 #-
            76  C1y C     2.2757  -17.1365
            77  C1y C     2.0339  -17.8557
            78  C1y C     3.0385  -17.1400
            79  O2x O     2.6087  -18.2503
            80  C1b C     1.1917  -18.1342
            81  C1y C     3.2699  -17.8668
            82  O1a O     3.4904  -16.5326
            83  O1a O     1.0141  -19.0130
            84  N4y N     5.9708  -15.9398
            85  C8y C     6.6901  -15.7125
            86  C8x C     5.5148  -15.3324
            87  C8y C     6.6901  -14.9456
            88  C8x C     7.3478  -16.0807
            89  N5x N     5.9708  -14.7107
            90  C8x C     7.3478  -14.5663
            91  C8y C     8.0098  -15.7125
            92  C8y C     8.0098  -14.9456
            93  C1a C     8.6676  -16.0807
            94  C1a C     8.6676  -14.5663
            95  O6a O     4.9820   -4.5629
BOND        102
            1     2   3 1
            2     1   2 1
            3     4   5 1
            4     4   6 1
            5     4   7 1
            6     5   8 1
            7     5   9 1
            8     5  10 1 #Down
            9     6  11 1
            10    6  12 1 #Up
            11    7  13 1
            12    7  14 1
            13    8  15 1
            14    8  16 1 #Up
            15    8  17 1 #Down
            16    9  18 2
            17   11  19 1 #Down
            18   11  20 1 #Up
            19   12  21 1
            20   13  22 2
            21   14   1 1
            22   15  23 1 #Down
            23   16  24 1
            24   18  25 1
            25   19  26 1
            26   21  27 1
            27   21  28 2
            28   22  29 1
            29   22  30 1
            30   23  31 1
            31   24  32 1
            32   24  33 2
            33   25  34 2
            34   25  35 1
            35   26  36 1
            36   29  37 1
            37   29  38 2
            38   31  39 1
            39   34  40 1
            40   34  41 1
            41   36  42 1
            42   36  43 2
            43   37  44 1
            44   37  45 1 #Down
            45   38  46 1
            46   39  47 1
            47   39  48 2
            48   40  49 1
            49   40  50 1 #Up
            50   40  51 1 #Down
            51   41  52 2
            52   42  53 1
            53   44  54 1
            54   44  55 1
            55   45  56 1
            56   46  57 2
            57   49  58 1 #Down
            58   50  59 1
            59   53  60 1
            60   56  61 1
            61   58  62 1
            62   59  63 1
            63   59  64 2
            64   60  65 1
            65   60  66 1 #Up
            66   61  67 1
            67   61  68 2
            68   62  69 1
            69   65  70 1
            70   69  71 1
            71   69  72 2
            72   70  73 1
            73   70  74 2
            74   70  75 1
            75   76  73 1 #Up
            76   76  77 1
            77   76  78 1
            78   77  79 1
            79   77  80 1 #Down
            80   78  81 1
            81   78  82 1 #Up
            82   80  83 1
            83   81  84 1 #Up
            84   84  85 1
            85   84  86 1
            86   85  87 2
            87   85  88 1
            88   86  89 2
            89   87  90 1
            90   88  91 2
            91   90  92 2
            92   91  93 1
            93   92  94 1
            94   11  13 1
            95   15  18 1
            96   44  46 1
            97   49  52 1
            98   52  57 1
            99   79  81 1
            100  87  89 1
            101  91  92 1
            102   2  95 2

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