KEGG   COMPOUND: C14476
Entry
C14476                      Compound                               
Name
Xanthomicrol;
4',5-Dihydroxy-6,7,8-trimethoxyflavone
Formula
C18H16O7
Exact mass
344.0896
Mol weight
344.3154
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C14476  Xanthomicrol
Other DBs
CAS: 16545-23-6
PubChem: 17395476
ChEBI: 35047
LIPIDMAPS: LMPK12111447
KNApSAcK: C00003879
NIKKAJI: J14.449E
LinkDB
KCF data

ATOM        25
            1   C8y C    32.4990  -25.8407
            2   C8x C    32.4990  -27.1716
            3   C8x C    31.2382  -25.1402
            4   C8x C    31.3082  -27.9421
            5   C8x C    30.0473  -25.8407
            6   C8y C    24.0230  -28.0823
            7   C8y C    25.2838  -27.3117
            8   C8y C    25.3540  -30.1837
            9   C8x C    28.9265  -29.3431
            10  C8y C    30.0473  -27.3117
            11  C8y C    24.0230  -29.4833
            12  C8y C    26.5448  -28.0122
            13  C8y C    26.5448  -29.4131
            14  C8y C    27.7357  -30.1137
            15  C8y C    28.9265  -28.0122
            16  O2a O    22.9024  -30.2538
            17  O5x O    27.7358  -31.4446
            18  O2x O    27.6657  -27.3117
            19  O1a O    33.7000  -25.1338
            20  O2a O    22.7881  -27.3897
            21  O1a O    25.3462  -31.5696
            22  C1a C    21.6244  -29.6446
            23  C1a C    22.8400  -25.9721
            24  O2a O    25.2534  -25.8847
            25  C1a C    26.4466  -25.1616
BOND        27
            1     1   2 2
            2     1   3 1
            3     2   4 1
            4     3   5 2
            5     4  10 2
            6     5  10 1
            7     6   7 2
            8     6  11 1
            9     7  12 1
            10    8  11 2
            11    8  13 1
            12    9  14 1
            13    9  15 2
            14   10  15 1
            15   11  16 1
            16   12  13 2
            17   12  18 1
            18   13  14 1
            19   14  17 2
            20   15  18 1
            21    1  19 1
            22    6  20 1
            23    8  21 1
            24   16  22 1
            25   20  23 1
            26    7  24 1
            27   24  25 1

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