KEGG   COMPOUND: C16981
Entry
C16981                      Compound                               
Name
Kaempferitrin;
Kaempferol 3,7-dirhamnoside;
Kaempferol-3,7-O-alpha-L-dirhamnoside;
Kaempferol-dirhamnoside;
Lespenefril
Formula
C27H30O14
Exact mass
578.1636
Mol weight
578.5187
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C16981  Kaempferitrin
Glycosides [BR:br08021]
 O-glycosides
  Flavonoid glycosides
   Flavones and flavonols
    C16981  Kaempferitrin
Dietary phytochemicals [br08012.html]
 Flavonoids
  C16981
Other DBs
CAS: 482-38-2
PubChem: 96023467
ChEBI: 68883
LIPIDMAPS: LMPK12111865
KNApSAcK: C00005189
NIKKAJI: J94.496C
LinkDB
KCF data

ATOM        41
            1   C8y C    28.5600  -20.7900
            2   C8y C    28.5600  -22.1200
            3   C8y C    27.3700  -22.8200
            4   C8x C    26.1100  -22.1200
            5   C8y C    26.1100  -20.7900
            6   C8x C    27.3700  -20.0900
            7   O2x O    29.6800  -20.0900
            8   C8y C    30.9400  -20.7900
            9   C8y C    30.9400  -22.1200
            10  C8y C    29.6800  -22.8200
            11  C8y C    32.1300  -20.0900
            12  C8x C    32.1300  -18.6900
            13  C8x C    33.3900  -17.9900
            14  C8y C    34.5800  -18.6900
            15  C8x C    34.5800  -20.0900
            16  C8x C    33.3900  -20.7900
            17  O1a O    35.7000  -17.9900
            18  O5x O    29.6800  -24.2200
            19  O1a O    27.3700  -24.2200
            20  O2a O    32.1300  -22.8200
            21  C1y C    32.1300  -24.2200
            22  C1y C    33.3200  -24.9200
            23  C1y C    33.3200  -26.3200
            24  C1y C    32.1300  -27.0200
            25  C1y C    30.9400  -26.3200
            26  O2x O    30.9400  -24.9200
            27  O1a O    34.5100  -26.9500
            28  O1a O    32.1300  -28.3500
            29  C1a C    29.7500  -27.0200
            30  O2a O    24.9034  -20.0800
            31  C1y C    23.6937  -20.7653
            32  O2x O    22.4734  -20.0470
            33  C1y C    21.2551  -20.7367
            34  C1y C    21.3132  -22.1366
            35  C1y C    22.4635  -22.8550
            36  C1y C    23.6818  -22.1653
            37  O1a O    24.8825  -22.8723
            38  O1a O    22.4342  -24.2195
            39  C1a C    20.0436  -20.0633
            40  O1a O    20.0861  -22.8512
            41  O1a O    34.5353  -24.2249
BOND        45
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    2  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   11  16 1
            19   14  17 1
            20   10  18 2
            21    3  19 1
            22    9  20 1
            23   21  20 1 #Up
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1
            29   21  26 1
            30   23  27 1 #Down
            31   24  28 1 #Up
            32   25  29 1 #Down
            33    5  30 1
            34   31  30 1 #Up
            35   31  32 1
            36   32  33 1
            37   33  34 1
            38   34  35 1
            39   35  36 1
            40   31  36 1
            41   36  37 1 #Down
            42   35  38 1 #Down
            43   33  39 1 #Down
            44   34  40 1 #Up
            45   22  41 1 #Down

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