KEGG   COMPOUND: C15109
Entry
C15109                      Compound                               
Name
Gardenin B;
5-Hydroxy-2-(4-methoxyphenyl)-6,7,8-trimethoxy-4H-1-benzopyran-4-one;
5-Hydroxy-4',6,7,8-tetramethoxyflavone;
Demethyltangeretin
Formula
C19H18O7
Exact mass
358.1053
Mol weight
358.342
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1211 Flavones and Flavonols
    C15109  Gardenin B
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavones
    C15109  Gardenin B
Other DBs
CAS: 2798-20-1
PubChem: 17396106
ChEBI: 79628
LIPIDMAPS: LMPK12111451
KNApSAcK: C00003883
NIKKAJI: J94.492K
LinkDB
KCF data

ATOM        26
            1   C8y C    20.4264  -16.0390
            2   C8y C    20.4264  -17.4331
            3   C8y C    21.6339  -18.1303
            4   C8x C    22.8416  -17.4331
            5   C8y C    22.8416  -16.0390
            6   O2x O    21.6339  -15.3417
            7   C8y C    19.2188  -15.3417
            8   C8y C    18.0110  -16.0390
            9   C8y C    18.0110  -17.4331
            10  C8y C    19.2188  -18.1303
            11  C8y C    24.0677  -15.3306
            12  C8x C    25.2680  -16.0237
            13  C8x C    26.4754  -15.3262
            14  C8y C    26.4754  -13.9317
            15  C8x C    25.2751  -13.2390
            16  C8x C    24.0676  -13.9361
            17  O2a O    27.6886  -13.2313
            18  O2a O    16.7848  -15.3306
            19  O2a O    16.7848  -18.1414
            20  O1a O    19.2188  -19.5247
            21  O5x O    21.6338  -19.5456
            22  C1a C    16.7857  -13.8992
            23  O2a O    19.2186  -13.9304
            24  C1a C    20.4545  -13.2164
            25  C1a C    15.5789  -17.4453
            26  C1a C    28.9238  -13.9447
BOND        28
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 1
            7     1   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 2
            11    2  10 1
            12    5  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   11  16 1
            19   14  17 1
            20    8  18 1
            21    9  19 1
            22   10  20 1
            23    3  21 2
            24   18  22 1
            25    7  23 1
            26   23  24 1
            27   19  25 1
            28   17  26 1

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