KEGG   COMPOUND: C02027
Entry
C02027                      Compound                               

Name
Deoxylimonate;
Deoxylimonic acid
Formula
C26H32O8
Exact mass
472.2097
Mol weight
472.5275
Structure
Reaction
Enzyme
Other DBs
PubChem: 5121
ChEBI: 17133
NIKKAJI: J2.735.423H
KCF data

ATOM        34
            1   C2y C    28.4885  -22.0537
            2   C2y C    27.2789  -22.7629
            3   C1x C    29.7108  -22.7566
            4   C1z C    28.4885  -20.6542
            5   C1y C    26.0694  -22.0727
            6   C7x C    30.9266  -22.0600
            7   C1y C    29.6982  -19.9449
            8   C1x C    27.2599  -19.9703
            9   C1a C    28.4821  -19.2736
            10  C1z C    24.8788  -22.7629
            11  C1x C    26.0504  -20.6795
            12  C1b C    26.2794  -24.7190
            13  O7x O    30.9204  -20.6477
            14  O6a O    32.1237  -22.7503
            15  C8y C    29.6918  -18.5644
            16  C1y C    24.8788  -24.1561
            17  C1y C    23.5554  -22.3450
            18  C1x C    25.6184  -21.6668
            19  C8x C    28.5708  -17.7600
            20  C8x C    30.8063  -17.7473
            21  C1z C    23.5489  -24.5868
            22  O2x O    22.7448  -23.4531
            23  C1x C    23.2451  -20.9834
            24  O7x O    25.1682  -20.4452
            25  C8x C    29.0016  -16.4491
            26  O2x O    30.3632  -16.4429
            27  C1a C    22.2950  -25.4099
            28  C1a C    23.5544  -26.2968
            29  C7x C    24.0420  -20.1862
            30  O6a O    23.3116  -18.8436
            31  C6a C    26.6418  -26.0713
            32  O6a O    25.6518  -27.0613
            33  O6a O    27.9941  -26.4337
            34  C1a C    27.2789  -24.1629
BOND        38
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     3   6 1
            6     4   7 1
            7     4   8 1
            8     4   9 1 #Down
            9     5  10 1
            10    5  11 1
            11    6  13 1
            12    6  14 2
            13    7  15 1 #Down
            14   10  16 1
            15   10  17 1
            16   10  18 1 #Up
            17   15  19 1
            18   15  20 2
            19   16  21 1
            20   17  22 1
            21   17  23 1
            22   18  24 1
            23   19  25 2
            24   20  26 1
            25   21  27 1
            26   21  28 1
            27   23  29 1
            28   29  30 2
            29    7  13 1
            30    8  11 1
            31   12  16 1
            32   21  22 1
            33   24  29 1
            34   25  26 1
            35   12  31 1
            36   31  32 2
            37   31  33 1
            38    2  34 1

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