KEGG   COMPOUND: C21491Help
Entry
C21491                      Compound                               

Name
(S)-Tembetarine
Formula
C20H26NO4
Exact mass
344.1862
Mol weight
344.4247
Structure
Mol fileKCF fileDB search
Reaction
Enzyme
Other DBs
CAS: 18446-73-6
PubChem: 333497474
KCF data Show

ATOM        25
            1   C8y C    14.8400  -20.7200
            2   C8y C    14.8400  -22.1200
            3   C8x C    16.0524  -22.8200
            4   C8y C    17.2649  -22.1200
            5   C8y C    17.2649  -20.7200
            6   C8x C    16.0524  -20.0200
            7   C1x C    18.4773  -22.8200
            8   C1x C    19.6897  -22.1200
            9   C1y C    18.4773  -20.0200
            10  O1a O    13.6276  -20.0200
            11  O2a O    13.6276  -22.8200
            12  C1b C    18.4773  -18.6200
            13  C8y C    19.6918  -17.9188
            14  C8x C    20.8883  -18.6098
            15  C8x C    22.1008  -17.9099
            16  C8y C    22.1009  -16.5099
            17  C8y C    20.9044  -15.8190
            18  C8x C    19.6919  -16.5188
            19  O1a O    20.9046  -14.4202
            20  O2a O    23.3232  -15.8043
            21  C1a C    12.4321  -22.1296
            22  C1a C    24.5324  -16.5025
            23  N2y N    19.6918  -20.7212 #+
            24  C1a C    20.8888  -20.0311
            25  C1a C    20.8866  -21.4128
BOND        27
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     5   9 1
            10    1  10 1
            11    2  11 1
            12    9  12 1 #Down
            13   12  13 1
            14   13  14 2
            15   14  15 1
            16   15  16 2
            17   16  17 1
            18   17  18 2
            19   13  18 1
            20   17  19 1
            21   16  20 1
            22   11  21 1
            23   20  22 1
            24    9  23 1
            25   23   8 1
            26   23  24 1
            27   23  25 1

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