KEGG   COMPOUND: C16491
Entry
C16491                      Compound                               
Name
Isovitexin 2''-O-arabinoside
Formula
C26H28O14
Exact mass
564.1479
Mol weight
564.4921
Structure
Reaction
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C16491  Isovitexin 2''-O-arabinoside
Glycosides [BR:br08021]
 C-glycosides
  C16491  Isovitexin 2''-O-arabinoside
Other DBs
PubChem: 47205787
ChEBI: 75435
KNApSAcK: C00014039
NIKKAJI: J1.887.405I
LinkDB
KCF data

ATOM        40
            1   C1y C    23.4500  -22.0500
            2   C1y C    23.4500  -23.4500
            3   C1y C    24.6624  -24.1500
            4   C1y C    25.8749  -23.4500
            5   C1x C    25.8749  -22.0500
            6   O2x O    24.6624  -21.3500
            7   C1y C    18.4800  -18.9700
            8   C1y C    18.4800  -20.3700
            9   C1y C    19.6924  -21.0700
            10  C1y C    20.9049  -20.3700
            11  C1y C    20.9049  -18.9700
            12  O2x O    19.6924  -18.2700
            13  C1b C    17.2676  -18.2700
            14  O1a O    16.0721  -18.9604
            15  O1a O    17.2676  -21.0700
            16  O1a O    19.6924  -22.4698
            17  O2a O    22.1360  -21.0810
            18  O1a O    22.2376  -24.1500
            19  O1a O    24.6624  -25.5498
            20  O1a O    27.1060  -24.1610
            21  C8y C    22.0500  -16.4500
            22  C8y C    22.0500  -17.8500
            23  C8y C    23.2624  -18.5500
            24  C8y C    24.4749  -17.8500
            25  C8y C    24.4749  -16.4500
            26  C8x C    23.2624  -15.7500
            27  C8y C    25.6873  -18.5500
            28  C8x C    26.8997  -17.8500
            29  C8y C    26.8997  -16.4500
            30  O2x O    25.6873  -15.7500
            31  O5x O    25.6873  -19.9500
            32  O1a O    23.2624  -19.9498
            33  O1a O    20.8376  -15.7500
            34  C8y C    28.0973  -15.7585
            35  C8x C    29.2856  -16.4445
            36  C8x C    30.4980  -15.7445
            37  C8y C    30.4980  -14.3445
            38  C8x C    29.3097  -13.6585
            39  C8x C    28.0973  -14.3585
            40  O1a O    31.7244  -13.6363
BOND        44
            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     7   8 1
            8     8   9 1
            9     9  10 1
            10   10  11 1
            11   11  12 1
            12    7  12 1
            13    7  13 1 #Up
            14   13  14 1
            15    8  15 1 #Down
            16    9  16 1 #Up
            17   10  17 1 #Down
            18    1  17 1 #Down
            19    2  18 1 #Up
            20    3  19 1 #Down
            21    4  20 1 #Down
            22   21  22 2
            23   22  23 1
            24   23  24 2
            25   24  25 1
            26   25  26 2
            27   21  26 1
            28   24  27 1
            29   27  28 1
            30   28  29 2
            31   29  30 1
            32   25  30 1
            33   27  31 2
            34   23  32 1
            35   21  33 1
            36   29  34 1
            37   34  35 2
            38   35  36 1
            39   36  37 2
            40   37  38 1
            41   38  39 2
            42   34  39 1
            43   37  40 1
            44   11  22 1 #Up

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