KEGG   DRUG: Oritavancin diphosphateHelp
Entry
D05271                      Drug                                   

Name
Oritavancin diphosphate (USAN);
Orbactiv (TN)
Product
Formula
C86H97Cl3N10O26. 2H3PO4
Exact mass
1986.5179
Mol weight
1989.0911
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Antibacterial
 DG01580  Glycopeptide antibiotic
Remark
ATC code: J01XA05
Chemical structure group: DG00632
Product (DG00632): D05271<US>
Efficacy
Antibacterial, Cell wall biosynthesis inhibitor
Target
peptidoglycan (D-Ala-D-Ala)
  Pathway
ko00550  Peptidoglycan biosynthesis
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 J ANTIINFECTIVES FOR SYSTEMIC USE
  J01 ANTIBACTERIALS FOR SYSTEMIC USE
   J01X OTHER ANTIBACTERIALS
    J01XA Glycopeptide antibacterials
     J01XA05 Oritavancin
      D05271  Oritavancin diphosphate (USAN) <US>
USP drug classification [BR:br08302]
 Antibacterials
  Antibacterials, Other
   Oritavancin
    D05271  Oritavancin diphosphate (USAN)
Antiinfectives [br08350.html]
 Antibacterials
  D05271
New drug approvals in the USA [br08319.html]
 New Molecular Entity and New Therapeutic Biological Product Approvals
  D05271
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D05271
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D05271
BRITE hierarchy
Other DBs
CAS: 192564-14-0
PubChem: 47206980
ChEBI: 83305
ChEMBL: CHEMBL3989766
LigandBox: D05271
LinkDB All DBs
KCF data Show

ATOM        135
            1   C8y C    34.6587  -24.1665
            2   C8y C    33.4743  -24.8405
            3   C8y C    35.8355  -24.8471
            4   O2a O    34.6596  -22.8043
            5   C8x C    33.4736  -26.2104
            6   O2x O    32.3052  -24.1599
            7   C8x C    35.8348  -26.2093
            8   O2x O    37.0274  -24.1882
            9   C1y C    35.7828  -21.0099
            10  C8y C    34.6576  -26.8984
            11  C8y C    31.1131  -24.8339
            12  C8y C    38.2116  -24.8688
            13  C1y C    35.7909  -19.6403
            14  O2x O    36.9666  -21.6980
            15  C1y C    34.6173  -28.2834
            16  C8y C    31.1050  -26.1961
            17  C8x C    29.9365  -24.1533
            18  C8y C    39.3961  -24.2025
            19  C8x C    38.2110  -26.2387
            20  O2a O    34.2270  -17.9355
            21  C1y C    36.9681  -18.9509
            22  C1y C    38.1590  -21.0089
            23  C5x C    33.5101  -28.9651
            24  N1x N    35.8559  -28.9717
            25  C8x C    29.9203  -26.8777
            26  X   Cl   32.2890  -26.8995
            27  C8x C    28.7595  -24.8198
            28  C8x C    40.5728  -24.8756
            29  X   Cl   39.4119  -22.8403
            30  C8x C    39.3948  -26.9269
            31  C1y C    35.8890  -15.9173
            32  C1y C    38.1598  -19.6315
            33  O1a O    36.9837  -17.5964
            34  C1b C    39.3430  -21.7122
            35  N1x N    32.3261  -28.2694
            36  O5x O    33.5094  -30.3273
            37  C5x C    37.0408  -28.2902
            38  C8y C    28.7514  -26.1820
            39  C8y C    40.5720  -26.2378
            40  C1x C    35.8972  -14.5476
            41  O2x O    37.0654  -16.5979
            42  O1a O    39.3520  -18.9729
            43  O1a O    40.7052  -21.7280
            44  C1y C    31.1488  -28.9510
            45  C1y C    38.2171  -28.9782
            46  O5x O    37.0564  -26.9280
            47  C1y C    27.5742  -26.8712
            48  C1y C    41.7560  -26.9410
            49  C1z C    37.0818  -13.8811
            50  C1y C    38.3200  -15.9316
            51  C8y C    31.1333  -30.3130
            52  C5x C    29.9725  -28.2630
            53  N1x N    39.4018  -28.2966
            54  C1b C    37.0327  -29.6597
            55  C1y C    27.5738  -28.2408
            56  O2a O    26.3979  -26.1755
            57  C1y C    41.7553  -28.3032
            58  O1a O    42.9483  -26.2672
            59  C1y C    38.2582  -14.5619
            60  C1a C    36.1340  -12.9144
            61  N1b N    38.0637  -12.9258
            62  C1a C    39.4340  -16.6121
            63  C8x C    29.9486  -30.9872
            64  C8x C    32.3173  -31.0015
            65  N1x N    28.7879  -28.9444
            66  O5x O    28.9867  -27.3562
            67  C5x C    40.5706  -28.9848
            68  C5a C    37.0318  -31.0221
            69  C5x C    26.3889  -28.9225
            70  N1b N    42.9393  -28.9914
            71  O1a O    39.4503  -13.8954
            72  C8y C    29.9403  -32.3569
            73  C8x C    32.3089  -32.3637
            74  O5x O    40.5702  -30.3470
            75  N1a N    38.2160  -31.7103
            76  O5a O    35.8473  -31.7035
            77  N1x N    26.3885  -30.2847
            78  O5x O    25.2126  -28.2266
            79  C5a C    44.1242  -28.3249
            80  C8y C    28.7484  -33.0157
            81  C8y C    31.1245  -33.0451
            82  C1y C    27.5725  -30.9729
            83  C1c C    45.3005  -29.0131
            84  O5a O    44.0698  -26.9629
            85  C8y C    27.5718  -32.3352
            86  C8y C    28.7477  -34.3856
            87  O1a O    31.1238  -34.4148
            88  C6a C    25.2791  -32.2684
            89  C1b C    45.2999  -30.3753
            90  N1b N    46.4927  -28.3468
            91  C8x C    26.3871  -33.0168
            92  C8x C    27.5705  -35.0670
            93  O1a O    29.9317  -35.0813
            94  O6a O    23.9171  -32.2601
            95  O6a O    25.2784  -33.6306
            96  C1c C    44.1229  -31.0570
            97  C1a C    47.6769  -29.0349
            98  C8y C    26.3865  -34.3865
            99  C1a C    42.4657  -31.0868
            100 C1a C    44.1222  -32.4192
            101 O1a O    25.2095  -35.0756
            102 C1y C    26.3898  -24.7972
            103 O2x O    27.5791  -24.1011
            104 C1y C    27.5709  -22.7231
            105 C1y C    26.3733  -22.0410
            106 C1z C    25.1838  -22.7371
            107 C1x C    25.1922  -24.1154
            108 C1a C    28.7602  -22.0269
            109 O1a O    26.3652  -20.6630
            110 C1a C    23.9719  -23.4157
            111 N1a N    24.2074  -21.7524
            112 C1b C    38.4175  -11.5991
            113 C8y C    39.7889  -11.6061
            114 C8x C    40.4686  -12.7976
            115 C8x C    40.4811  -10.4219
            116 C8x C    41.8528  -10.4289
            117 C8y C    42.5322  -11.6204
            118 C8y C    43.9039  -11.6277
            119 C8x C    41.8402  -12.8049
            120 C8x C    44.5835  -12.8191
            121 C8x C    44.5958  -10.4434
            122 C8x C    45.9675  -10.4505
            123 C8y C    46.6472  -11.6419
            124 C8x C    45.9552  -12.8261
            125 X   Cl   48.0188  -11.6492
            126 P1b P    47.3061  -19.9854
            127 O1c O    47.3061  -18.5927
            128 O1c O    47.3061  -21.3781
            129 O1c O    48.7685  -19.9854
            130 O1c O    45.9831  -19.9854
            131 P1b P    47.3061  -19.9854
            132 O1c O    47.3061  -21.3781
            133 O1c O    48.7685  -19.9854
            134 O1c O    45.9831  -19.9854
            135 O1c O    47.3061  -18.5927
BOND        145
            1    16  25 2
            2    16  26 1
            3    17  27 1
            4    18  28 2
            5    18  29 1
            6    19  30 1
            7    31  20 1 #Up
            8    21  32 1
            9    21  33 1 #Up
            10   22  34 1 #Up
            11   23  35 1
            12   23  36 2
            13   24  37 1
            14   25  38 1
            15   28  39 1
            16   31  40 1
            17   31  41 1
            18   32  42 1 #Down
            19   34  43 1
            20   44  35 1 #Down
            21   37  45 1
            22   37  46 2
            23   38  47 1
            24   39  48 1
            25   40  49 1
            26   41  50 1
            27   44  51 1
            28   44  52 1
            29   45  53 1
            30   45  54 1 #Up
            31   47  55 1
            32   47  56 1 #Down
            33   48  57 1
            34   48  58 1 #Up
            35   49  59 1
            36   49  60 1 #Up
            37   49  61 1 #Down
            38   50  62 1 #Down
            39   51  63 1
            40   51  64 2
            41   52  65 1
            42   52  66 2
            43   53  67 1
            44   54  68 1
            45   55  69 1
            46   57  70 1 #Up
            47   59  71 1 #Up
            48   63  72 2
            49   64  73 1
            50   67  74 2
            51   68  75 1
            52   68  76 2
            53   69  77 1
            54   69  78 2
            55   70  79 1
            56   72  80 1
            57   72  81 1
            58   77  82 1
            59   79  83 1
            60   79  84 2
            61   80  85 2
            62   80  86 1
            63   81  87 1
            64   82  88 1 #Down
            65   83  89 1
            66   83  90 1 #Down
            67   85  91 1
            68   86  92 2
            69   86  93 1
            70   88  94 1
            71   88  95 2
            72   89  96 1
            73   90  97 1
            74   91  98 2
            75   96  99 1
            76   96 100 1
            77   98 101 1
            78    7  10 2
            79   22  32 1
            80   27  38 2
            81   30  39 2
            82   50  59 1
            83   55  65 1 #Down
            84   57  67 1
            85   73  81 2
            86   82  85 1
            87   92  98 1
            88  102  56 1 #Up
            89    1   2 1
            90    1   3 2
            91    1   4 1
            92    2   5 2
            93    2   6 1
            94  102 103 1
            95  103 104 1
            96  104 105 1
            97  105 106 1
            98  106 107 1
            99  107 102 1
            100   3   7 1
            101 104 108 1 #Down
            102   3   8 1
            103 105 109 1 #Up
            104   9   4 1 #Up
            105 106 110 1 #Up
            106   5  10 1
            107 106 111 1 #Down
            108   6  11 1
            109  61 112 1
            110   8  12 1
            111 112 113 1
            112   9  13 1
            113 113 114 2
            114   9  14 1
            115 113 115 1
            116  10  15 1
            117 115 116 2
            118 114 119 1
            119  11  16 1
            120 116 117 1
            121  11  17 2
            122 117 118 1
            123  12  18 1
            124 117 119 2
            125  12  19 2
            126 118 120 2
            127  13  20 1 #Down
            128 118 121 1
            129  13  21 1
            130 121 122 2
            131  14  22 1
            132 122 123 1
            133  15  23 1
            134 123 124 2
            135 120 124 1
            136  15  24 1 #Up
            137 123 125 1
            138 126 128 1
            139 126 129 1
            140 126 130 1
            141 126 127 2
            142 131 132 1
            143 131 133 1
            144 131 134 1
            145 131 135 2
BRACKET     1    44.5200  -22.1900   44.5200  -17.9900
            1    50.1200  -17.9900   50.1200  -22.1900
            1  2
 ORIGINAL  1  126 128 129 130 127
 REPEAT    1  131 132 133 134 135

» Japanese version   » Back

DBGET integrated database retrieval system