KEGG   DRUG: NabiloneHelp
Entry
D05099                      Drug                                   

Name
Nabilone (USAN/INN);
Cesamet (TN)
Product
Formula
C24H36O3
Exact mass
372.2664
Mol weight
372.5408
Structure
Mol fileKCF fileDB search
Class
Gastrointestinal agent
 DG01762  Antiemetic
Remark
ATC code: A04AD11
Product: D05099<US>
Efficacy
Anti-emetic, Minor tranquilizer, Cannabinoid receptor agonist
Comment
Cannabinol derivative
Target
CNR [HSA:1268 1269] [KO:K04277 K04278]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A04 ANTIEMETICS AND ANTINAUSEANTS
   A04A ANTIEMETICS AND ANTINAUSEANTS
    A04AD Other antiemetics
     A04AD11 Nabilone
      D05099  Nabilone (USAN/INN) <US>
USP drug classification [BR:br08302]
 Antiemetics
  Emetogenic Therapy Adjuncts
   Nabilone
    D05099  Nabilone (USAN/INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Cannabinoid
    CNR
     D05099  Nabilone (USAN/INN) <US>
Drug classes of therapeutic agents [br08360.html]
 Gastrointestinal agents
  D05099
BRITE hierarchy
Other DBs
CAS: 51022-71-0
PubChem: 47206824
ChEMBL: CHEMBL155472 CHEMBL947
DrugBank: DB00486
LigandBox: D05099
LinkDB All DBs
KCF data Show

ATOM        27
            1   C1y C    17.9915  -18.8133
            2   C8y C    19.1687  -19.4953
            3   C1y C    16.8026  -19.4953
            4   C1x C    17.9972  -17.4495
            5   C8y C    19.1687  -20.8708
            6   C8y C    20.3577  -18.8133
            7   C1z C    16.8026  -20.8708
            8   C1x C    15.6193  -18.8076
            9   C5x C    16.8084  -16.7618
            10  O2x O    17.9915  -21.5526
            11  C8x C    20.3577  -21.5526
            12  C8x C    21.5351  -19.4953
            13  O1a O    20.3577  -17.4438
            14  C1a C    16.8200  -22.5433
            15  C1a C    15.2348  -21.5818
            16  C1x C    15.6193  -17.4438
            17  O5x O    16.8141  -15.3981
            18  C8y C    21.5351  -20.8708
            19  C1d C    22.7182  -21.5526
            20  C1b C    23.9071  -20.8648
            21  C1b C    25.0843  -21.5468
            22  C1b C    26.2733  -20.8648
            23  C1b C    27.4505  -21.5468
            24  C1a C    21.7282  -22.5425
            25  C1a C    23.7081  -22.5425
            26  C1b C    28.6504  -20.8565
            27  C1a C    29.8479  -21.5505
BOND        29
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 1
            11    6  12 2
            12    6  13 1
            13    7  14 1
            14    7  15 1
            15    8  16 1
            16    9  17 2
            17   11  18 2
            18   18  19 1
            19   19  20 1
            20   20  21 1
            21   21  22 1
            22   22  23 1
            23    7  10 1
            24    9  16 1
            25   12  18 1
            26   19  24 1
            27   19  25 1
            28   23  26 1
            29   26  27 1

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