KEGG   COMPOUND: C10024
Entry
C10024                      Compound                               
Name
Baicalein 5,6,7-trimethyl ether
Formula
C18H16O5
Exact mass
312.0998
Mol weight
312.3166
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C10024  Baicalein 5,6,7-trimethyl ether
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavones
    C10024  Baicalein 5,6,7-trimethyl ether
Other DBs
CAS: 973-67-1
PubChem: 12210
ChEBI: 2980
LIPIDMAPS: LMPK12111100
KNApSAcK: C00003808
3DMET: B03468
NIKKAJI: J345.874A
KCF data

ATOM        23
            1   C8y C    28.2108  -16.2412
            2   C8y C    28.2051  -17.6441
            3   O2x O    29.4218  -15.5483
            4   C8x C    27.0000  -15.5483
            5   C8y C    27.0000  -18.3427
            6   C8y C    29.4101  -18.3485
            7   C8y C    30.6326  -16.2528
            8   C8y C    25.7832  -16.2412
            9   C8y C    25.7832  -17.6441
            10  O2a O    27.0057  -19.7457
            11  C8x C    30.6269  -17.6499
            12  O5x O    29.4042  -19.7516
            13  C8y C    31.8436  -15.5600
            14  O2a O    24.5722  -15.5426
            15  O2a O    24.5722  -18.3485
            16  C1a C    25.7949  -20.4502
            17  C8x C    33.0545  -16.2702
            18  C8x C    31.8494  -14.1628
            19  C1a C    23.3614  -16.2412
            20  C1a C    23.3614  -17.6441
            21  C8x C    34.2712  -15.5775
            22  C8x C    33.0661  -13.4641
            23  C8x C    34.2769  -14.1744
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 2
            9     5  10 1
            10    6  11 1
            11    6  12 2
            12    7  13 1
            13    8  14 1
            14    9  15 1
            15   10  16 1
            16   13  17 2
            17   13  18 1
            18   14  19 1
            19   15  20 1
            20   17  21 1
            21   18  22 2
            22   21  23 2
            23    7  11 2
            24    8   9 1
            25   22  23 1

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