KEGG   COMPOUND: C03946Help
Entry
C03946                      Compound                               

Name
Flavonol 3-O-beta-D-glucoside;
Flavonol 3-O-D-glucoside
Formula
C21H20O8
Exact mass
400.1158
Mol weight
400.3787
Structure
Mol fileKCF fileDB search
Comment
Generic compound in reaction hierarchy
Reaction
Enzyme
2.3.1.116       2.4.1.91        2.4.1.159       2.4.1.239
Brite
Glycosides [BR:br08021]
 O-glycosides
  Flavonoid glycosides
   Flavones and flavonols
    C03946  Flavonol 3-O-beta-D-glucoside
BRITE hierarchy
Other DBs
PubChem: 6669
ChEBI: 16816
NIKKAJI: J397.687D
KCF data Show

ATOM        29
            1   C8y C    28.3240  -19.1467
            2   C8y C    28.3811  -20.6211
            3   C8y C    29.5344  -18.4450
            4   O2x O    27.0878  -18.4385
            5   C8y C    27.0943  -21.2843
            6   O2a O    29.5150  -21.2586
            7   C8x C    29.5279  -17.0542
            8   C8x C    30.7512  -19.1403
            9   C8y C    25.8581  -19.1596
            10  C8y C    25.8581  -20.5759
            11  O5x O    27.0685  -22.6298
            12  C1y C    30.7320  -21.9602
            13  C8x C    30.7320  -16.3397
            14  C8x C    31.8917  -18.4385
            15  C8x C    24.6284  -18.4579
            16  C8x C    24.6284  -21.2907
            17  O2x O    31.9488  -21.2586
            18  C1y C    30.7320  -23.3639
            19  C8x C    31.9488  -17.0350
            20  C8x C    23.4180  -19.1596
            21  C8x C    23.4180  -20.5759
            22  C1y C    33.1656  -21.9602
            23  C1y C    31.9488  -24.0656
            24  O1a O    29.5150  -24.0656
            25  C1y C    33.1656  -23.3639
            26  C1b C    34.3631  -21.2586
            27  O1a O    31.9488  -25.4627
            28  O1a O    34.3631  -24.0656
            29  O1a O    35.4384  -22.1663
BOND        32
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 2
            7     3   8 1
            8     4   9 1
            9     5  10 1
            10    5  11 2
            11   12   6 1 #Down
            12    7  13 1
            13    8  14 2
            14    9  15 1
            15   10  16 1
            16   12  17 1
            17   12  18 1
            18   13  19 2
            19   15  20 2
            20   16  21 2
            21   17  22 1
            22   18  23 1
            23   18  24 1 #Up
            24   22  25 1
            25   22  26 1 #Down
            26   23  27 1 #Down
            27   25  28 1 #Up
            28   26  29 1
            29    9  10 2
            30   14  19 1
            31   20  21 1
            32   23  25 1

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