KEGG   DRUG: D00682Help
Entry
D00682                      Drug                                   

Name
Carboprost tromethamine (USP);
Hemabate (TN)
Product
Formula
C21H36O5. C4H11NO3
Exact mass
489.3302
Mol weight
489.6426
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Oxytocic
Remark
ATC code: 
Drug group: 
Target
prostaglandin F receptor agonist [HSA:5737] [KO:K04262]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction  
 
Interaction
Drug interaction
Structure map
Prostaglandins
Eicosanoid receptor agonists/antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 G GENITO URINARY SYSTEM AND SEX HORMONES
  G02 OTHER GYNECOLOGICALS
   G02A UTEROTONICS
    G02AD Prostaglandins
     G02AD04 Carboprost
      D00682  Carboprost tromethamine (USP)
USP drug classification [BR:br08302]
 Hormonal Agents, Stimulant/Replacement/Modifying (Prostaglandins)
  Carboprost
   D00682  Carboprost tromethamine (USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostaglandin
    prostaglandin F receptor
     Carboprost
      D00682  Carboprost tromethamine (USP)
BRITE hierarchy
Other DBs
CAS: 
58551-69-2
PubChem: 
DrugBank: 
LigandBox: 
KCF data Show

ATOM        34
            1   C1d C    34.6935  -15.9249
            2   C1b C    33.5499  -15.2656
            3   C1b C    34.6935  -17.2730
            4   C1b C    35.8373  -15.2830
            5   N1a N    34.7345  -14.0985
            6   O1a O    32.4061  -15.9249
            7   O1a O    35.8373  -17.9323
            8   O1a O    36.9985  -15.9425
            9   C1b C    25.0549  -14.0436
            10  C1b C    26.2479  -14.7324
            11  C1b C    27.4409  -14.0436
            12  C6a C    28.6340  -14.7324
            13  O6a O    29.8270  -14.0436
            14  C1y C    20.0540  -16.5233
            15  C1y C    20.0540  -15.1457
            16  C1y C    18.7453  -14.7324
            17  C1x C    17.9188  -15.8345
            18  C1y C    18.7453  -16.9366
            19  O1a O    18.3242  -13.4208
            20  O1a O    18.3242  -18.2483
            21  C1b C    21.2470  -14.0436
            22  C2b C    22.3713  -14.7324
            23  C2b C    23.9555  -14.7324
            24  O6a O    28.6340  -16.1097
            25  C2b C    21.2470  -17.6943
            26  C2b C    22.4401  -17.0055
            27  C1d C    23.6331  -17.6943
            28  C1b C    24.8261  -17.0055
            29  C1b C    26.0192  -17.6943
            30  C1b C    27.2122  -17.0055
            31  C1b C    28.4052  -17.6943
            32  C1a C    22.6591  -18.6683
            33  O1a O    24.6073  -18.6683
            34  C1a C    29.5856  -17.0127
BOND        33
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     3   7 1
            7     4   8 1
            8     9  10 1
            9    10  11 1
            10   11  12 1
            11   12  13 1
            12   14  15 1
            13   15  16 1
            14   16  17 1
            15   17  18 1
            16   14  18 1
            17   16  19 1 #Down
            18   18  20 1 #Down
            19   15  21 1 #Down
            20   21  22 1
            21   22  23 2
            22    9  23 1
            23   12  24 2
            24   14  25 1 #Up
            25   25  26 2
            26   26  27 1
            27   27  28 1
            28   28  29 1
            29   29  30 1
            30   30  31 1
            31   27  32 1 #Up
            32   27  33 1 #Down
            33   31  34 1

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