KEGG   COMPOUND: C10122
Entry
C10122                      Compound                               
Name
Quercetagetin;
6-Hydroxyquercetin
Formula
C15H10O8
Exact mass
318.0376
Mol weight
318.2351
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C10122  Quercetagetin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavonols
    C10122  Quercetagetin
Other DBs
CAS: 90-18-6
PubChem: 12308
ChEBI: 8695
LIPIDMAPS: LMPK12112983
KNApSAcK: C00004677
PDB-CCD: MYU[PDBj]
3DMET: B03560
NIKKAJI: J10.601A
KCF data

ATOM        23
            1   C8y C    26.9913  -17.2609
            2   C8y C    26.9856  -18.6604
            3   O2x O    28.2101  -16.5611
            4   C8x C    25.7785  -16.5552
            5   C8y C    28.1984  -19.3660
            6   C8y C    25.7785  -19.3602
            7   C8y C    29.4231  -17.2726
            8   C8y C    24.5714  -17.2609
            9   C8y C    29.4172  -18.6721
            10  O5x O    28.1927  -20.7596
            11  C8y C    24.5714  -18.6604
            12  O1a O    25.7842  -20.7538
            13  C8y C    30.6419  -16.5728
            14  O1a O    23.3585  -16.5669
            15  O1a O    30.6185  -19.3776
            16  O1a O    23.3643  -19.3602
            17  C8x C    30.6419  -15.1673
            18  C8x C    31.8547  -17.2783
            19  C8y C    31.8605  -14.4677
            20  C8x C    33.0676  -16.5785
            21  C8y C    33.0735  -15.1733
            22  O1a O    31.8605  -13.0739
            23  O1a O    34.2863  -14.4792
BOND        25
            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     4   8 2
            8     5   9 1
            9     5  10 2
            10    6  11 2
            11    6  12 1
            12    7  13 1
            13    8  14 1
            14    9  15 1
            15   11  16 1
            16   13  17 1
            17   13  18 2
            18   17  19 2
            19   18  20 1
            20   19  21 1
            21   19  22 1
            22   21  23 1
            23    7   9 2
            24    8  11 1
            25   20  21 2

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