KEGG   DRUG: Prostalene
Entry
D05642                      Drug                                   
Name
Prostalene (USAN);
Synchrocept (TN)
Formula
C22H36O5
Exact mass
380.2563
Mol weight
380.5182
Structure
Simcomp
Efficacy
Oxytocic
Comment
Prostaglandin F2 alpha analogue
Target
PTGFR [HSA:5737] [KO:K04262]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Prostaglandin
    PTGFR
     D05642  Prostalene (USAN)
Other DBs
CAS: 54120-61-5
PubChem: 47207304
LigandBox: D05642
LinkDB
KCF data

ATOM        27
            1   C1y C    21.4180  -21.2459
            2   C1y C    21.4407  -19.8725
            3   C1y C    20.0286  -19.5591
            4   C1x C    19.3158  -20.7387
            5   C1y C    20.2173  -21.7811
            6   O1a O    19.4982  -18.3002
            7   O1a O    19.9066  -23.1114
            8   C2b C    22.6670  -22.3034
            9   C2b C    23.8583  -21.6473
            10  C1d C    25.0369  -22.3597
            11  C1b C    26.2344  -21.6999
            12  O1a O    24.0547  -23.5502
            13  C1a C    26.0191  -23.4113
            14  C1b C    27.4301  -22.4224
            15  C1b C    28.6400  -21.7560
            16  C1b C    29.8091  -22.4629
            17  C1a C    31.0226  -21.7946
            18  C1b C    22.6324  -19.1800
            19  C2b C    23.8449  -19.8800
            20  C0  C    25.2449  -19.8800
            21  C2b C    26.6449  -19.8800
            22  C1b C    27.8824  -19.1800
            23  C1b C    29.0949  -19.8800
            24  C7a C    30.3073  -19.1800
            25  O7a O    31.5197  -19.8800
            26  C1a C    32.7322  -19.1800
            27  O6a O    30.3073  -17.7800
BOND        27
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     3   6 1 #Down
            7     5   7 1 #Down
            8     8   9 2
            9     9  10 1
            10   10  11 1
            11    1   8 1 #Up
            12   10  12 1 #Up
            13   10  13 1 #Down
            14   11  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18    2  18 1 #Down
            19   18  19 1
            20   19  20 2
            21   20  21 2
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   24  25 1
            26   25  26 1
            27   24  27 2

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