KEGG   COMPOUND: C08658Help
Entry
C08658                      Compound                               

Name
Anopterine
Formula
C31H43NO7
Exact mass
541.304
Mol weight
541.6756
Structure
Mol fileKCF fileDB search
Brite
Phytochemical compounds [BR:br08003]
 Alkaloids
  Alkaloids derived by amination reactions
   Terpenoid alkaloids
    C08658  Anopterine
BRITE hierarchy
Other DBs
CAS: 38826-62-9
PubChem: 10851
ChEBI: 2746
ChEMBL: CHEMBL503221
KNApSAcK: C00001614
3DMET: B05271
NIKKAJI: J17.934E
KCF data Show

ATOM        39
            1   C1z C    25.6732  -19.1031
            2   C1y C    26.7630  -18.4794
            3   C1y C    25.6615  -17.8443
            4   C1z C    25.6673  -20.3678
            5   C1x C    24.5832  -18.4678
            6   C1z C    27.8412  -19.1205
            7   C1y C    26.7104  -17.2322
            8   C1y C    28.9369  -18.5027
            9   N1y N    24.1228  -19.7383
            10  C1z C    24.5832  -20.9913
            11  C1y C    26.7514  -20.9973
            12  O1a O    25.6556  -21.6208
            13  C1y C    23.4877  -19.1031
            14  C1x C    27.8528  -20.3736
            15  C1x C    28.9312  -19.7442
            16  C1y C    27.8704  -16.6145
            17  O7a O    25.6906  -16.5912
            18  C1y C    28.9427  -17.2556
            19  C1x C    24.1521  -22.0113
            20  C1a C    21.7799  -19.7383
            21  C1x C    23.4877  -20.3678
            22  C1a C    24.9916  -22.8918
            23  O1a O    26.7397  -22.2618
            24  O1a O    22.3800  -18.2054
            25  C2y C    30.0267  -17.8791
            26  O7a O    27.8645  -15.3614
            27  C7a C    25.0612  -15.5012
            28  C2a C    31.1225  -17.2439
            29  C7a C    28.4765  -14.2716
            30  C2c C    23.8081  -15.5012
            31  O6a O    25.6849  -14.4056
            32  C2c C    29.7296  -14.2716
            33  O6a O    27.8471  -13.1759
            34  C2b C    23.1787  -16.5912
            35  C1a C    23.1670  -14.4056
            36  C2b C    30.3648  -15.3555
            37  C1a C    30.3590  -13.1816
            38  C1a C    21.9199  -16.5912
            39  C1a C    31.6178  -15.3555
BOND        44
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     1   5 1
            5     2   6 1
            6     2   7 1
            7     3   8 1
            8     3   9 1
            9     4  10 1
            10    4  11 1
            11    4  12 1 #Up
            12    5  13 1
            13    6  14 1
            14    6  15 1
            15    7  16 1
            16    7  17 1 #Down
            17   18   8 1 #Down
            18    9  19 1
            19    9  20 1
            20   10  21 1
            21   10  22 1 #Up
            22   11  23 1 #Down
            23   13  24 1 #Down
            24   15  25 1
            25   16  26 1 #Down
            26   17  27 1
            27   25  28 2
            28   26  29 1
            29   27  30 1
            30   27  31 2
            31   29  32 1
            32   29  33 2
            33   30  34 2
            34   30  35 1
            35   32  36 2
            36   32  37 1
            37   34  38 1
            38   36  39 1
            39    6   8 1 #Down
            40   10  19 1 #Down
            41   11  14 1
            42   13  21 1
            43   16  18 1
            44   18  25 1

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