KEGG   COMPOUND: C10073Help
Entry
C10073                      Compound                               

Name
Hyperin;
Quercetin 3-galactoside
Formula
C21H20O12
Exact mass
464.0955
Mol weight
464.3763
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C10073  Hyperin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavonols
    C10073  Hyperin
BRITE hierarchy
Other DBs
CAS: 482-36-0
PubChem: 12259
ChEBI: 67486
ChEMBL: CHEMBL2337335 CHEMBL251254
KNApSAcK: C00005372
3DMET: B03515
NIKKAJI: J12.400A
LinkDB All DBs
KCF data Show

ATOM        33
            1   C8y C    28.7174  -15.4932
            2   C8y C    28.7115  -16.8875
            3   C8y C    29.9249  -14.7988
            4   O2x O    27.5097  -14.7988
            5   C8y C    27.5038  -17.5818
            6   O2a O    29.9075  -17.5935
            7   C8x C    29.9249  -13.4102
            8   C8x C    31.1269  -15.4932
            9   C8y C    26.3078  -15.4872
            10  C8y C    26.3020  -16.8817
            11  O5x O    27.4921  -18.9762
            12  C1y C    31.3836  -18.4102
            13  C8y C    31.1269  -12.7043
            14  C8x C    32.3346  -14.7988
            15  C8x C    25.1001  -14.7930
            16  C8y C    25.1001  -17.5759
            17  O2x O    31.3895  -19.7988
            18  C1y C    32.5796  -17.7160
            19  C8y C    32.3346  -13.4102
            20  O1a O    31.1210  -11.3158
            21  C8y C    23.8866  -15.4872
            22  C8x C    23.8924  -16.8875
            23  O1a O    25.1001  -18.9704
            24  C1y C    32.5972  -20.4872
            25  C1y C    33.7873  -18.3985
            26  O1a O    32.5738  -16.3215
            27  O1a O    33.5481  -12.7043
            28  O1a O    22.6730  -14.7988
            29  C1y C    33.7932  -19.7871
            30  C1b C    32.6029  -21.8758
            31  O1a O    34.9950  -17.7043
            32  O1a O    35.0007  -20.4815
            33  O1a O    31.4012  -22.5759
BOND        36
            1     1   2 2
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1
            6     3   7 1
            7     3   8 2
            8     4   9 1
            9     5  10 1
            10    5  11 2
            11   12   6 1 #Up
            12    7  13 2
            13    8  14 1
            14    9  15 1
            15   10  16 1
            16   12  17 1
            17   12  18 1
            18   13  19 1
            19   13  20 1
            20   15  21 2
            21   16  22 2
            22   16  23 1
            23   17  24 1
            24   18  25 1
            25   18  26 1 #Down
            26   19  27 1
            27   21  28 1
            28   24  29 1
            29   24  30 1 #Up
            30   25  31 1 #Up
            31   29  32 1 #Up
            32   30  33 1
            33    9  10 2
            34   14  19 2
            35   21  22 1
            36   25  29 1

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