KEGG   DRUG: Octreotide acetate
Entry
D06495                      Drug                                   
Name
Octreotide acetate (USP);
Sandostatin (TN)
Product
MYCAPSSA (Amryt Pharmaceuticals Designated Activity Company), MYCAPSSA (Chiesi USA), SANDOSTATIN (Novartis Pharmaceuticals Corporation), SANDOSTATIN LAR DEPOT (Novartis Pharmaceuticals Corporation)
  Generic
OCTREOTIDE (Fresenius Kabi USA), OCTREOTIDE (Fresenius Kabi USA), OCTREOTIDE ACETATE (GLENMARK PHARMACEUTICALS), OCTREOTIDE ACETATE (Gland Pharma Limited), OCTREOTIDE ACETATE (Gland Pharma Limited), OCTREOTIDE ACETATE (Heritage Pharmaceuticals Inc. d/b/a Avet Pharmaceuticals), OCTREOTIDE ACETATE (Hikma Pharmaceuticals USA), OCTREOTIDE ACETATE (Mylan Institutional LLC), OCTREOTIDE ACETATE (Sagent Pharmaceuticals)
Formula
C49H66N10O10S2. (C2H4O2)x
Structure
Simcomp
Class
Hormonal agent
 DG01588  Somatostatin receptor agonist
Remark
ATC code: H01CB02
Chemical structure group: DG00501
Product (DG00501): D02250<JP> D06495<US>
Efficacy
Antisecretory (hormone), Somatostatin receptor agonist
  Disease
Acromegaly [DS:H01483]
Carcinoid tumors [DS:H00034]
Target
SSTR2 [HSA:6752] [KO:K04218]
  Pathway
hsa04024  cAMP signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04935  Growth hormone synthesis, secretion and action
hsa04971  Gastric acid secretion
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 H SYSTEMIC HORMONAL PREPARATIONS, EXCL. SEX HORMONES AND INSULINS
  H01 PITUITARY AND HYPOTHALAMIC HORMONES AND ANALOGUES
   H01C HYPOTHALAMIC HORMONES
    H01CB Somatostatin and analogues
     H01CB02 Octreotide
      D06495  Octreotide acetate (USP) <US>
USP drug classification [BR:br08302]
 Antineoplastics
  Antineoplastics, Other
   Octreotide
    D06495  Octreotide acetate (USP)
 Hormonal Agents, Suppressant (Pituitary)
  Octreotide
   D06495  Octreotide acetate (USP)
Drug groups [BR:br08330]
 Hormonal agent
  DG01588  Somatostatin receptor agonist
   DG00501  Octreotide
    D06495  Octreotide acetate
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Somatostatin
    SSTR2
     D06495  Octreotide acetate (USP) <US>
New drug approvals in Europe [br08329.html]
 European public assessment reports (EPAR) authorised medicine
  D06495
New drug approvals in the USA, Europe and Japan [br08328.html]
 Approval dates by FDA, EMA and PMDA
  D06495
Drug groups [BR:br08330]
 Hormonal agent
  DG01588  Somatostatin receptor agonist
   DG00501  Octreotide
Other DBs
CAS: 79517-01-4
PubChem: 47208151
LigandBox: D06495
NIKKAJI: J398.406K
LinkDB
KCF data

ATOM        75
            1   C8y C    31.8509  -22.8967
            2   C8x C    31.1501  -24.1115
            3   C8x C    31.8042  -25.3262
            4   C8x C    33.2058  -25.3262
            5   C8x C    33.9534  -24.1115
            6   C8y C    33.2526  -22.8967
            7   N4x N    33.6731  -21.5885
            8   C8x C    32.5517  -20.7475
            9   C8y C    31.4304  -21.5885
            10  N1b N    24.1419  -14.5336
            11  C1y C    25.3567  -15.2344
            12  C1x C    26.5714  -14.5336
            13  S3x S    27.7862  -15.2344
            14  S3x S    29.0009  -14.5336
            15  C1x C    30.2157  -15.2344
            16  C1y C    31.4304  -14.5336
            17  N1x N    32.6452  -15.2344
            18  C5x C    25.3567  -16.6828
            19  O5x O    24.1419  -17.3836
            20  C5x C    33.8599  -14.5336
            21  C1y C    35.0747  -15.2344
            22  O5x O    33.8599  -13.1320
            23  N1x N    35.0747  -16.6828
            24  C1c C    36.2894  -14.5336
            25  O1a O    37.5042  -15.2344
            26  C1a C    36.2894  -13.1320
            27  C5x C    33.8599  -17.3836
            28  C1y C    33.8599  -18.7852
            29  O5x O    32.6452  -16.6828
            30  N1x N    32.6452  -19.4861
            31  C5x C    31.4304  -18.7852
            32  C1y C    30.2157  -19.4861
            33  O5x O    31.4304  -17.3836
            34  N1x N    29.0009  -18.7852
            35  C5x C    27.7862  -19.4861
            36  C1y C    26.5714  -18.7852
            37  C1b C    25.3100  -19.4861
            38  N1x N    26.5714  -17.3369
            39  O5x O    27.7862  -20.8877
            40  C8y C    25.3100  -20.8877
            41  C5a C    31.4304  -13.1320
            42  O5a O    32.6452  -12.4312
            43  N1b N    30.2157  -12.4312
            44  C1c C    30.2157  -11.0762
            45  C1c C    29.0009  -10.3754
            46  C1b C    31.4304  -10.3754
            47  O1a O    32.6452  -11.0295
            48  C1a C    27.7862  -11.0762
            49  O1a O    29.0009   -8.9738
            50  C5a C    22.9272  -15.2344
            51  C1c C    21.7124  -14.5336
            52  O5a O    22.9272  -16.6361
            53  N1a N    21.7124  -13.1787
            54  C1b C    20.4977  -15.2344
            55  C8x C    24.1419  -21.5418
            56  C8x C    24.1419  -22.9434
            57  C8x C    25.3100  -23.6442
            58  C8x C    26.5247  -22.9434
            59  C8x C    26.5247  -21.5885
            60  C1b C    30.2157  -20.8877
            61  C1b C    35.0747  -19.4861
            62  C1b C    36.2894  -18.7385
            63  C1b C    37.5042  -19.4393
            64  C1b C    38.7189  -18.7385
            65  N1a N    39.9337  -19.4393
            66  C8y C    19.2829  -14.5803
            67  C8x C    19.2829  -13.1787
            68  C8x C    18.0682  -12.4779
            69  C8x C    16.8534  -13.1787
            70  C8x C    16.8534  -14.5803
            71  C8x C    18.0682  -15.2812
            72  C1a C    19.5723  -24.4307
            73  C6a C    20.7852  -23.7310
            74  O6a O    20.7852  -22.3315
            75  O6a O    21.9981  -24.4307
BOND        78
            1    36  38 1
            2    12  13 1
            3    35  39 2
            4    21  24 1
            5    37  40 1
            6     6   1 2
            7    16  41 1
            8    41  42 2
            9    41  43 1
            10   43  44 1
            11    6   7 1
            12   44  45 1
            13    7   8 1
            14   44  46 1
            15    8   9 2
            16   46  47 1
            17    9   1 1
            18   45  48 1
            19    1   2 1
            20   45  49 1
            21    2   3 2
            22   10  50 1
            23    3   4 1
            24   50  51 1
            25    4   5 2
            26   50  52 2
            27    5   6 1
            28   51  53 1
            29   16  17 1
            30   51  54 1
            31   24  25 1
            32   24  26 1
            33   11  18 1
            34   23  27 1
            35   13  14 1
            36   40  55 2
            37   55  56 1
            38   56  57 2
            39   57  58 1
            40   58  59 2
            41   59  40 1
            42   27  28 1
            43   32  60 1
            44   60   9 1
            45   18  19 2
            46   28  61 1
            47   27  29 2
            48   61  62 1
            49   18  38 1
            50   62  63 1
            51   28  30 1
            52   63  64 1
            53   11  12 1
            54   64  65 1
            55   30  31 1
            56   54  66 1
            57   17  20 1
            58   31  32 1
            59   14  15 1
            60   31  33 2
            61   20  21 1
            62   66  67 2
            63   67  68 1
            64   68  69 2
            65   69  70 1
            66   70  71 2
            67   71  66 1
            68   32  34 1
            69   10  11 1
            70   34  35 1
            71   20  22 2
            72   35  36 1
            73   15  16 1
            74   36  37 1
            75   21  23 1
            76   72  73 1
            77   73  74 2
            78   73  75 1
BRACKET     1    17.7800  -25.2000   17.7800  -21.4900
            1    23.1700  -21.4900   23.1700  -25.2000
            1  x
 ORIGINAL  1   72  73  74  75
 REPEAT    1

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