KEGG   COMPOUND: C17750
Entry
C17750                      Compound                               

Name
Curcumin diglucoside
Formula
C33H40O16
Exact mass
692.2316
Mol weight
692.6611
Structure
Reaction
Pathway
map00945  Stilbenoid, diarylheptanoid and gingerol biosynthesis
Enzyme
2.4.1.-
Other DBs
PubChem: 96024077
ChEBI: 81315
NIKKAJI: J2.829.453K
KCF data

ATOM        49
            1   C8y C    27.2300  -25.9700
            2   C8x C    26.0400  -25.2700
            3   C8x C    27.2300  -27.3700
            4   C2b C    28.4200  -25.2700
            5   C8y C    24.7800  -25.9700
            6   C8x C    26.0400  -28.0700
            7   C2b C    29.6800  -25.9700
            8   C8y C    24.7800  -27.3700
            9   O2a O    23.5900  -25.2700
            10  C5a C    30.9400  -25.2700
            11  O2a O    23.5900  -28.0700
            12  C1a C    22.4000  -25.9700
            13  C2b C    32.1300  -25.9700
            14  O5a O    30.9400  -23.8700
            15  C2c C    33.3200  -25.2700
            16  C2b C    34.5800  -25.9700
            17  O1a O    33.3200  -23.8700
            18  C2b C    35.7700  -25.2700
            19  C8y C    36.9600  -25.9700
            20  C8x C    38.1500  -25.2700
            21  C8x C    36.9600  -27.3700
            22  C8y C    39.4100  -25.9700
            23  C8x C    38.1500  -28.0700
            24  C8y C    39.4100  -27.3700
            25  O2a O    40.6000  -25.2700
            26  O2a O    40.6000  -28.0700
            27  C1a C    41.7900  -25.9700
            28  C1y C    23.5900  -29.4700
            29  O2x O    22.4000  -30.2400
            30  C1y C    22.4000  -31.6400
            31  C1y C    23.5900  -32.3400
            32  C1y C    24.7800  -31.6400
            33  C1y C    24.7800  -30.2400
            34  C1b C    21.2100  -32.3400
            35  O1a O    21.2100  -33.7400
            36  O1a O    23.5900  -33.7400
            37  O1a O    25.9700  -32.3400
            38  O1a O    25.9700  -29.4700
            39  C1y C    40.6000  -29.4700
            40  C1y C    39.4100  -30.1700
            41  C1y C    39.4100  -31.5700
            42  C1y C    40.6000  -32.2700
            43  C1y C    41.7900  -31.5700
            44  O2x O    41.7900  -30.1700
            45  C1b C    42.9800  -32.2700
            46  O1a O    42.9800  -33.6700
            47  O1a O    40.6000  -33.6700
            48  O1a O    38.2200  -32.2700
            49  O1a O    38.2200  -29.4700
BOND        52
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     3   6 1
            6     4   7 2
            7     5   8 1
            8     5   9 1
            9     7  10 1
            10    8  11 1
            11    9  12 1
            12   10  13 1
            13   10  14 2
            14   13  15 2
            15   15  16 1
            16   15  17 1
            17   16  18 2
            18   18  19 1
            19   19  20 1
            20   19  21 2
            21   20  22 2
            22   21  23 1
            23   22  24 1
            24   22  25 1
            25   24  26 1
            26   25  27 1
            27    6   8 2
            28   23  24 2
            29   28  11 1 #Up
            30   28  29 1
            31   29  30 1
            32   30  31 1
            33   31  32 1
            34   32  33 1
            35   28  33 1
            36   30  34 1 #Up
            37   34  35 1
            38   31  36 1 #Down
            39   32  37 1 #Up
            40   33  38 1 #Down
            41   39  26 1 #Down
            42   39  40 1
            43   40  41 1
            44   41  42 1
            45   42  43 1
            46   43  44 1
            47   39  44 1
            48   43  45 1 #Down
            49   45  46 1
            50   42  47 1 #Up
            51   41  48 1 #Down
            52   40  49 1 #Up

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