KEGG   COMPOUND: C20468
Entry
C20468                      Compound                               

Name
Cyanidin 3-O-(beta-D-xylosyl-(1->2)-beta-D-galactoside)
Formula
C26H29O15
Exact mass
581.1506
Mol weight
581.4995
Structure
Reaction
Enzyme
Other DBs
PubChem: 163312205
KCF data

ATOM        41
            1   C1y C    24.8500  -13.4400
            2   O2x O    24.8500  -14.8400
            3   C1x C    26.0624  -15.5400
            4   C1y C    27.2749  -14.8400
            5   C1y C    27.2749  -13.4400
            6   C1y C    26.0624  -12.7400
            7   O1a O    26.0624  -11.3402
            8   O1a O    28.5060  -12.7290
            9   O1a O    28.5060  -15.5510
            10  C8y C    18.5793  -12.6178
            11  C8y C    18.5793  -14.0174
            12  C8y C    19.7866  -11.9179
            13  O2x O    17.3720  -11.9179 #+
            14  O2a O    19.9848  -16.2456
            15  C8x C    17.3720  -14.7055
            16  C8x C    20.9939  -12.6178
            17  C8x C    19.7807  -10.5182
            18  C8y C    16.1589  -12.6178
            19  C1y C    21.1864  -16.9512
            20  C8y C    16.1589  -14.0174
            21  C8y C    22.2012  -11.9179
            22  C8x C    20.9939   -9.8240
            23  C8x C    14.9516  -11.9179
            24  O2x O    21.1804  -18.3393
            25  C1y C    22.3877  -16.2573
            26  C8y C    14.9516  -14.7115
            27  C8y C    22.2012  -10.5182
            28  O1a O    23.4142  -12.6119
            29  C8y C    13.7443  -12.6178
            30  C1y C    22.3761  -19.0335
            31  C1y C    23.5893  -16.9629
            32  O2a O    22.3994  -14.8692
            33  C8x C    13.7443  -14.0174
            34  O1a O    14.9516  -16.0996
            35  O1a O    23.4085   -9.8240
            36  O1a O    12.5370  -11.9237
            37  C1y C    23.5776  -18.3510
            38  C1b C    22.3644  -20.4216
            39  O1a O    24.8023  -16.2747
            40  O1a O    24.7849  -19.0509
            41  O1a O    21.1630  -21.1098
BOND        45
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     6   7 1 #Down
            8     5   8 1 #Up
            9     4   9 1 #Down
            10   10  11 1
            11   10  12 1
            12   10  13 2
            13   11  14 1
            14   11  15 2
            15   12  16 2
            16   12  17 1
            17   13  18 1
            18   19  14 1 #Up
            19   15  20 1
            20   16  21 1
            21   17  22 2
            22   18  23 1
            23   19  24 1
            24   19  25 1
            25   20  26 1
            26   21  27 2
            27   21  28 1
            28   23  29 2
            29   24  30 1
            30   25  31 1
            31   25  32 1 #Down
            32   26  33 2
            33   26  34 1
            34   27  35 1
            35   29  36 1
            36   30  37 1
            37   30  38 1 #Up
            38   31  39 1 #Up
            39   37  40 1 #Up
            40   38  41 1
            41   18  20 2
            42   22  27 1
            43   29  33 1
            44   31  37 1
            45    1  32 1 #Up

» Japanese version

DBGET integrated database retrieval system