KEGG   COMPOUND: C14212Help
Entry
C14212                      Compound                               

Name
Nafoxidine
Formula
C29H31NO2
Exact mass
425.2355
Mol weight
425.5619
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 1845-11-0
PubChem: 7847022
ChEBI: 34881
ChEMBL: CHEMBL28211
NIKKAJI: J7.793C
LinkDB All DBs
KCF data Show

ATOM        32
            1   C1x C    18.5156  -16.9897
            2   C8y C    18.5156  -18.3933
            3   C8y C    19.7311  -19.0951
            4   C2y C    20.9467  -18.3933
            5   C2y C    20.9467  -16.9897
            6   C1x C    19.7311  -16.2879
            7   C8x C    17.3001  -19.0951
            8   C8y C    17.3001  -20.4987
            9   C8x C    18.5156  -21.2005
            10  C8x C    19.7311  -20.4987
            11  C8y C    22.1809  -19.1061
            12  C8x C    22.1806  -20.4986
            13  C8x C    23.3960  -21.2007
            14  C8y C    24.6117  -20.4992
            15  C8x C    24.6120  -19.1067
            16  C8x C    23.3966  -18.4046
            17  C8y C    22.1809  -16.2769
            18  C8x C    23.3892  -16.9744
            19  C8x C    24.6046  -16.2725
            20  C8x C    24.6046  -14.8689
            21  C8x C    23.3963  -14.1715
            22  C8x C    22.1808  -14.8733
            23  O2a O    25.8367  -21.2005
            24  C1b C    27.0523  -20.4987
            25  C1b C    28.2678  -21.2005
            26  N1y N    29.4833  -20.4987
            27  C1x C    30.6040  -21.3168
            28  C1x C    31.7246  -20.5020
            29  C1x C    31.2961  -19.1845
            30  C1x C    29.9106  -19.1849
            31  O2a O    16.1015  -21.1908
            32  C1a C    14.9111  -20.5036
BOND        36
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     2   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    3  10 1
            12    4  11 1
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16   14  15 2
            17   15  16 1
            18   11  16 2
            19    5  17 1
            20   17  18 2
            21   18  19 1
            22   19  20 2
            23   20  21 1
            24   21  22 2
            25   17  22 1
            26   14  23 1
            27   23  24 1
            28   24  25 1
            29   25  26 1
            30   26  27 1
            31   27  28 1
            32   28  29 1
            33   29  30 1
            34   26  30 1
            35    8  31 1
            36   31  32 1

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