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
map01110  Biosynthesis of secondary metabolites
Enzyme
2.4.1.-
Other DBs
PubChem: 96024077
ChEBI: 81315
NIKKAJI: J2.829.453K
LinkDB
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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