KEGG   COMPOUND: C09726
Entry
C09726                      Compound                               
Name
Dracorubin
Formula
C32H24O5
Exact mass
488.1624
Mol weight
488.53
Structure
Brite
Phytochemical compounds [BR:br08003]
 Flavonoids
  Complex flavonoids
   Proanthocyanidins
    C09726  Dracorubin
Other DBs
CAS: 6219-63-2
PubChem: 11914
ChEBI: 4714
KNApSAcK: C00000955
3DMET: B03225
NIKKAJI: J92.499G
LinkDB
KCF data

ATOM        37
            1   C8y C    24.1416  -16.4332
            2   C8y C    24.1416  -17.8365
            3   C8y C    22.9362  -15.7228
            4   C8x C    25.4345  -15.7402
            5   C8y C    25.3469  -18.5237
            6   C8y C    22.9188  -18.5237
            7   C8y C    21.7191  -16.4157
            8   C8y C    22.9478  -14.3193
            9   C8y C    25.3762  -14.3426
            10  C8y C    25.3412  -19.9270
            11  O2x O    26.5640  -17.8306
            12  O2x O    21.7077  -17.8191
            13  C8x C    22.9188  -19.9270
            14  C8y C    20.5139  -15.7052
            15  O2x O    24.1708  -13.6322
            16  C8x C    21.7367  -13.6148
            17  C8y C    26.5932  -13.6555
            18  C8y C    24.1358  -20.6258
            19  C1x C    26.5523  -20.6317
            20  C1y C    27.7753  -18.5353
            21  C8y C    20.5254  -14.3019
            22  C1a C    19.2969  -16.3983
            23  C8x C    27.7984  -14.3659
            24  C8x C    26.6049  -12.2580
            25  O2a O    24.1416  -22.0292
            26  C1x C    27.7694  -19.9329
            27  O5x O    19.3202  -13.5973
            28  C8x C    29.0214  -13.6788
            29  C8x C    27.8276  -11.5651
            30  C1a C    25.3529  -22.7221
            31  C8x C    29.0330  -12.2755
            32  C8y C    28.9922  -17.8423
            33  C8x C    30.1918  -18.5470
            34  C8x C    28.9922  -16.4449
            35  C8x C    31.4088  -17.8539
            36  C8x C    30.2035  -15.7461
            37  C8x C    31.4146  -16.4565
BOND        43
            1     3   7 1
            2     3   8 1
            3     4   9 2
            4     5  10 2
            5     5  11 1
            6     6  12 1
            7     6  13 1
            8     7  14 2
            9     8  15 1
            10    8  16 2
            11    9  17 1
            12   10  18 1
            13   10  19 1
            14   11  20 1
            15   14  21 1
            16   14  22 1
            17   17  23 2
            18   17  24 1
            19   18  25 1
            20   19  26 1
            21   21  27 2
            22   23  28 1
            23   24  29 2
            24   25  30 1
            25   28  31 2
            26    7  12 1
            27    9  15 1
            28   13  18 2
            29   16  21 1
            30   20  26 1
            31   29  31 1
            32   20  32 1 #Down
            33    1   2 1
            34    1   3 2
            35    1   4 1
            36    2   5 1
            37    2   6 2
            38   32  33 2
            39   32  34 1
            40   33  35 1
            41   34  36 2
            42   35  37 2
            43   36  37 1

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