KEGG   COMPOUND: C07052Help
Entry
C07052                      Compound                               

Name
Ipratropium
Formula
C20H30NO3
Exact mass
332.2226
Mol weight
332.4571
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
60205-81-4
PubChem: 
ChEBI: 
NIKKAJI: 
KCF data Show

ATOM        24
            1   C1x C    14.2100  -17.0100
            2   C1x C    14.5600  -15.8200
            3   C1y C    15.4000  -16.7300
            4   C1y C    15.7500  -15.5400
            5   N2y N    14.4900  -14.2100 #+
            6   C1x C    17.2900  -16.7300
            7   C1x C    17.0100  -15.5400
            8   C1y C    18.3400  -17.2900
            9   O7a O    19.3900  -18.1300
            10  C7a C    20.5800  -18.1300
            11  C1c C    21.2100  -17.0800
            12  O6a O    21.2100  -19.3200
            13  C8y C    22.4700  -17.0800
            14  C1b C    20.5800  -16.0300
            15  O1a O    21.2100  -14.9800
            16  C8x C    23.1700  -18.3400
            17  C8x C    24.5700  -18.3400
            18  C8x C    25.2700  -17.0800
            19  C8x C    24.5700  -15.8900
            20  C8x C    23.1700  -15.8900
            21  C1a C    13.2300  -14.8400
            22  C1c C    14.4900  -12.8100
            23  C1a C    15.7024  -12.1100
            24  C1a C    13.2776  -12.1100
BOND        26
            1     1   2 1
            2     1   3 1
            3     2   4 1
            4     3   5 1
            5     3   6 1
            6     4   7 1
            7     6   8 1
            8     8   9 1 #Down
            9     9  10 1
            10   10  11 1
            11   10  12 2
            12   11  13 1
            13   11  14 1
            14   14  15 1
            15    4   5 1
            16    7   8 1
            17   13  16 2
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21   19  20 2
            22   13  20 1
            23    5  21 1 #Down
            24    5  22 1 #Up
            25   22  23 1
            26   22  24 1

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