KEGG   COMPOUND: C04443
Entry
C04443                      Compound                               
Name
3-O-Methylquercetin;
3',4',5,7-Tetrahydroxy-3-methoxyflavone;
3-Methoxy-5,7,3',4'-tetrahydroxyflavone
Formula
C16H12O7
Exact mass
316.0583
Mol weight
316.26
Structure
Reaction
R02157 R05323
Pathway
map00944  Flavone and flavonol biosynthesis
map01110  Biosynthesis of secondary metabolites
Enzyme
2.1.1.76        2.1.1.82
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C04443  3-O-Methylquercetin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavonols
    C04443  3-O-Methylquercetin
Other DBs
PubChem: 7072
ChEBI: 16860
LIPIDMAPS: LMPK12112729
KNApSAcK: C00004632
NIKKAJI: J876A
LinkDB
KCF data

ATOM        23
            1   C8y C    24.5859  -16.5604
            2   C8x C    24.5859  -17.9609
            3   C8y C    25.8018  -18.6612
            4   C8x C    25.8018  -15.8601
            5   C8y C    27.0105  -16.5604
            6   C8y C    27.0045  -17.9609
            7   C8y C    28.2144  -18.6664
            8   C8y C    29.5002  -17.9713
            9   C8y C    29.4364  -16.5707
            10  O2x O    28.2265  -15.8654
            11  C8y C    30.6522  -15.8757
            12  C8x C    31.8584  -16.5845
            13  C8y C    33.1442  -15.8893
            14  C8y C    33.0803  -14.4888
            15  C8x C    31.8704  -13.7834
            16  C8x C    30.6544  -14.4784
            17  O1a O    34.2961  -13.7938
            18  O2a O    30.6401  -18.6768
            19  O5x O    28.2085  -20.0670
            20  O1a O    25.8051  -20.0617
            21  O1a O    23.3735  -15.8596
            22  O1a O    34.2841  -16.5948
            23  C1a C    30.6267  -20.0760
BOND        25
            1     9  11 1
            2     1   2 2
            3     2   3 1
            4     3   6 2
            5     5   4 2
            6     4   1 1
            7    11  12 2
            8    12  13 1
            9    13  14 2
            10   14  15 1
            11   15  16 2
            12   16  11 1
            13    5   6 1
            14   14  17 1
            15    6   7 1
            16    8  18 1
            17    7   8 1
            18    7  19 2
            19    8   9 2
            20    3  20 1
            21    9  10 1
            22    1  21 1
            23   10   5 1
            24   13  22 1
            25   18  23 1

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