KEGG   COMPOUND: C22608
Entry
C22608                      Compound                               
Name
Avicularin;
Quercetin 3-O-alpha-L-arabinofuranoside
Formula
C20H18O11
Exact mass
434.0849
Mol weight
434.3503
Structure
Brite
Dietary phytochemicals [br08012.html]
 Flavonoids
  C22608
Other DBs
CAS: 572-30-5
KCF data

ATOM        31
            1   C1y C    19.6726  -21.4178
            2   C1y C    21.0537  -21.4316
            3   O2x O    19.2715  -20.1127
            4   C1b C    18.8572  -22.5055
            5   C1y C    21.5124  -20.1189
            6   O1a O    21.8391  -22.5564
            7   C1y C    20.4284  -19.3117
            8   O1a O    19.6084  -23.6518
            9   O1a O    22.8154  -19.7239
            10  C8y C    16.8000  -17.0100
            11  C8y C    16.8000  -15.6100
            12  C8y C    17.9900  -17.7100
            13  C8y C    15.6100  -17.7100
            14  O2x O    18.0600  -14.9100
            15  C8x C    15.6100  -14.9100
            16  C8y C    19.2500  -17.0100
            17  O5x O    17.9900  -19.1100
            18  C8x C    14.4200  -17.0100
            19  O1a O    15.6100  -19.1100
            20  C8y C    19.2500  -15.6100
            21  C8y C    14.4200  -15.6100
            22  O2a O    20.4400  -17.7100
            23  C8y C    20.4400  -14.9100
            24  O1a O    13.1600  -14.9100
            25  C8x C    21.6300  -15.6100
            26  C8x C    20.4400  -13.5100
            27  C8y C    22.8900  -14.9100
            28  C8x C    21.7000  -12.8100
            29  C8y C    22.8900  -13.5100
            30  O1a O    24.0800  -15.6100
            31  O1a O    24.0800  -12.8100
BOND        34
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 1 #Up
            6     3   7 1
            7     4   8 1
            8     5   9 1 #Down
            9     5   7 1
            10   10  11 1
            11   10  12 1
            12   10  13 2
            13   11  14 1
            14   11  15 2
            15   12  16 1
            16   12  17 2
            17   13  18 1
            18   13  19 1
            19   14  20 1
            20   15  21 1
            21   16  22 1
            22   20  23 1
            23   21  24 1
            24   23  25 2
            25   23  26 1
            26   25  27 1
            27   26  28 2
            28   27  29 2
            29   27  30 1
            30   29  31 1
            31   16  20 2
            32   18  21 2
            33   28  29 1
            34    7  22 1 #Up

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