KEGG   COMPOUND: C07420
Entry
C07420                      Compound                               
Name
Pentamidine
Formula
C19H24N4O2
Exact mass
340.1899
Mol weight
340.4195
Structure
Remark
Same as: D08333
Other DBs
CAS: 100-33-4
PubChem: 9624
ChEBI: 45081
PDB-CCD: PNT[PDBj]
NIKKAJI: J5.512C
KCF data

ATOM        25
            1   C8y C    24.7800  -17.1500
            2   C8x C    24.7800  -18.5500
            3   C8x C    25.9700  -19.2500
            4   C8y C    27.2300  -18.5500
            5   C8x C    27.2300  -17.1500
            6   C8x C    25.9700  -16.4500
            7   C2c C    23.5900  -16.4500
            8   N1a N    22.4000  -17.1500
            9   N2a N    23.5900  -15.0500
            10  O2a O    28.4200  -19.2500
            11  C1b C    29.6800  -18.5500
            12  C1b C    30.8700  -19.2500
            13  C1b C    32.0600  -18.5500
            14  C1b C    33.2500  -19.2500
            15  C1b C    34.5100  -18.5500
            16  O2a O    35.7000  -19.2500
            17  C8y C    36.8900  -18.5500
            18  C8x C    38.1500  -19.2500
            19  C8x C    39.3400  -18.5500
            20  C8y C    39.3400  -17.1500
            21  C8x C    38.1500  -16.4500
            22  C8x C    36.8900  -17.1500
            23  C2c C    40.6000  -16.4500
            24  N1a N    41.7900  -17.1500
            25  N2a N    40.6000  -15.0500
BOND        26
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     7   9 2
            10    4  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   17  18 2
            19   18  19 1
            20   19  20 2
            21   20  21 1
            22   21  22 2
            23   17  22 1
            24   20  23 1
            25   23  24 1
            26   23  25 2

» Japanese version

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Drug (1)   
   KEGG DRUG (1)   
Chemical substance (6)   
   PubChem (1)   
   ChEBI (1)   
   HMDB (1)   
   HSDB (1)   
   NIKKAJI (1)   
   PDB-CCD (1)   
All databases (7)   

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