KEGG   DRUG: Vinblastine sulfate
Entry
D01068                      Drug                                   
Name
Vinblastine sulfate (JP18/USP);
Exal (TN);
Velban (TN)
Product
  Generic
VINBLASTINE SULFATE (Fresenius Kabi USA)
Formula
C46H58N4O9. H2SO4
Exact mass
908.3878
Mol weight
909.05
Structure
Simcomp
Source
Catharanthus roseus [TAX:4058]
Class
Antineoplastic
 DG01965  Vinca alkaloid antineoplastic
Metabolizing enzyme substrate
 DG01633  CYP3A/CYP3A4 substrate
  DG02913  CYP3A4 substrate
Remark
Same as: C11626
Therapeutic category: 4240
ATC code: L01CA01
Chemical structure group: DG00689
Product (DG00689): D01068<JP/US>
Efficacy
Antineoplastic, Tubulin polymerization inhibitor
  Disease
Hodgkin's disease [DS:H00007]
Mycosis fungoides [DS:H01463]
Carcinoma of the testis [DS:H00023]
Kaposi's sarcoma [DS:H00041]
Letterer-Siwe disease [DS:H01512]
Choriocarcinoma [DS:H00028]
Carcinoma of the breast [DS:H00031]
Comment
Vinca alkaloid
Target
TUBB [HSA:10381 10382 10383 203068 347688 347733 7280 81027 84617] [KO:K07375]
  Pathway
hsa04540  Gap junction
Metabolism
Enzyme: CYP3A4 [HSA:1576]
Interaction
Structure map
map07042  Antineoplastics - agents from natural products
map07046  Immunosuppressive agents
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
  L01 ANTINEOPLASTIC AGENTS
   L01C PLANT ALKALOIDS AND OTHER NATURAL PRODUCTS
    L01CA Vinca alkaloids and analogues
     L01CA01 Vinblastine
      D01068  Vinblastine sulfate (JP18/USP) <JP/US>
Therapeutic category of drugs in Japan [BR:br08301]
 4  Agents affecting cellular function
  42  Antineoplastics
   424  Plant extract preparations
    4240  Plant extract preparations
     D01068  Vinblastine sulfate (JP18/USP)
Drug groups [BR:br08330]
 Antineoplastic
  DG01965  Vinca alkaloid antineoplastic
   DG00689  Vinblastine
    D01068  Vinblastine sulfate
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG00689  Vinblastine
     D01068  Vinblastine sulfate
Target-based classification of drugs [BR:br08310]
 Not elsewhere classified
  Cellular process
   Cytoskeleton
    TUBB
     D01068  Vinblastine sulfate (JP18/USP) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D01068  Vinblastine sulfate
  D01068  Vinblastine sulfate for injection
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D01068
Drug groups [BR:br08330]
 Antineoplastic
  DG01965  Vinca alkaloid antineoplastic
   DG00689  Vinblastine
 Metabolizing enzyme substrate
  DG01633  CYP3A/CYP3A4 substrate
   DG02913  CYP3A4 substrate
    DG00689  Vinblastine
Other DBs
CAS: 143-67-9
PubChem: 7848131
ChEBI: 9984
LigandBox: D01068
NIKKAJI: J524.971F
LinkDB
KCF data

ATOM        64
            1   S4a S    32.3820  -14.5300
            2   O1d O    32.3820  -13.1300
            3   O1d O    32.3820  -15.9300
            4   O1d O    30.9819  -14.5300
            5   O1d O    33.7819  -14.5300
            6   C1z C    19.8800  -17.4300
            7   C8y C    18.7600  -16.6600
            8   C1x C    21.1400  -16.6600
            9   C7a C    19.5300  -18.6900
            10  C8y C    18.7600  -15.2600
            11  N4x N    17.6400  -17.2900
            12  C1y C    21.1400  -15.4000
            13  O7a O    18.0600  -19.1800
            14  O6a O    20.3700  -19.7400
            15  C8y C    16.4500  -15.2600
            16  C1x C    17.9900  -14.1400
            17  C8y C    16.4500  -16.6600
            18  C1x C    20.0200  -14.7700
            19  C1a C    17.2200  -20.5800
            20  C8x C    15.2600  -14.6300
            21  C1x C    18.7600  -13.1600
            22  C8x C    15.2600  -17.2900
            23  N1y N    20.0200  -13.5100
            24  C8x C    14.2100  -15.2600
            25  C8x C    14.2100  -16.6600
            26  C1x C    21.1400  -12.7400
            27  C1z C    22.2600  -13.3700
            28  C1x C    22.2600  -14.5600
            29  O1a O    23.5200  -12.6700
            30  C1b C    23.4724  -14.0700
            31  C1a C    23.4725  -15.4698
            32  C1z C    27.4400  -19.6000
            33  C1y C    28.5600  -18.9000
            34  C1y C    27.4400  -20.8600
            35  C1x C    26.6000  -18.4800
            36  C1z C    29.6800  -19.6000
            37  N1y N    28.5600  -17.5700
            38  C1z C    28.5600  -21.5600
            39  N1y N    26.3200  -21.5600
            40  C8y C    25.2000  -20.8600
            41  C1x C    27.2300  -17.5700
            42  C1y C    29.6800  -20.8600
            43  C2x C    30.8700  -18.9000
            44  C1b C    30.8000  -20.2300
            45  C1x C    29.6800  -16.9400
            46  C7a C    29.4700  -22.6800
            47  O1a O    28.0700  -23.4500
            48  C1a C    26.3200  -22.8900
            49  O7a O    33.0400  -22.1900
            50  C2x C    30.8700  -17.5700
            51  C1a C    31.9200  -19.6000
            52  O7a O    29.4700  -24.0100
            53  O6a O    30.8000  -22.1900
            54  C1a C    30.6600  -24.7100
            55  C1a C    35.4900  -22.1900
            56  C7a C    34.2300  -21.4900
            57  O6a O    34.2300  -20.0900
            58  C8y C    25.2000  -19.6000
            59  C8x C    24.0800  -18.9700
            60  C8x C    24.0800  -21.5600
            61  C8y C    22.9600  -19.6000
            62  C8y C    22.9600  -20.9300
            63  O2a O    21.8400  -21.5600
            64  C1a C    20.7200  -20.9300
BOND        71
            1     1   2 2
            2     1   3 2
            3     1   4 1
            4     1   5 1
            5     6   7 1
            6     6   8 1
            7     6   9 1 #Up
            8     7  10 2
            9     7  11 1
            10    8  12 1
            11    9  13 1
            12    9  14 2
            13   10  15 1
            14   10  16 1
            15   11  17 1
            16   12  18 1 #Down
            17   12  28 1
            18   13  19 1
            19   15  20 1
            20   16  21 1
            21   17  22 1
            22   23  18 1 #Down
            23   20  24 2
            24   22  25 2
            25   23  26 1
            26   15  17 2
            27   21  23 1
            28   27  26 1
            29   24  25 1
            30   27  28 1
            31   27  29 1 #Up
            32   27  30 1 #Down
            33   30  31 1
            34   32  33 1
            35   32  34 1
            36   32  35 1 #Up
            37   33  36 1
            38   33  37 1
            39   34  38 1
            40   34  39 1
            41   35  41 1
            42   36  42 1
            43   36  43 1
            44   36  44 1 #Down
            45   37  45 1
            46   38  46 1 #Down
            47   38  47 1 #Up
            48   39  48 1
            49   42  49 1 #Up
            50   43  50 2
            51   44  51 1
            52   46  52 1
            53   37  41 1
            54   38  42 1
            55   39  40 1
            56   45  50 1
            57   46  53 2
            58   52  54 1
            59   55  56 1
            60   49  56 1
            61   56  57 2
            62   58  59 1
            63   40  60 1
            64   59  61 2
            65   60  62 2
            66   62  63 1
            67   63  64 1
            68   61  62 1
            69   58  32 1
            70   58  40 2
            71    6  61 1 #Down

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