KEGG   COMPOUND: C09650
Entry
C09650                      Compound                               
Name
7,4'-Dihydroxy-8-methylflavan
Formula
C16H16O3
Exact mass
256.1099
Mol weight
256.2964
Structure
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1202 Flavans, Flavanols and Leucoanthocyanidins
    C09650  7,4'-Dihydroxy-8-methylflavan
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavans
    C09650  7,4'-Dihydroxy-8-methylflavan
Other DBs
CAS: 75412-98-5
PubChem: 11840
ChEBI: 2245
LIPIDMAPS: LMPK12020230
KNApSAcK: C00000953
3DMET: B03163
NIKKAJI: J2.771.074C
KCF data

ATOM        19
            1   C8y C    24.5793  -20.4862
            2   C8y C    24.5735  -21.8901
            3   O2x O    25.7966  -19.7932
            4   C8y C    23.3678  -19.7874
            5   C1x C    25.7850  -22.5948
            6   C8x C    23.3678  -22.5890
            7   C1y C    27.0023  -20.4979
            8   C8y C    22.1564  -20.4862
            9   C1a C    23.3738  -18.3895
            10  C1x C    26.9966  -21.8958
            11  C8x C    22.1564  -21.8901
            12  O1a O    20.9391  -19.7874
            13  C8y C    28.2197  -19.8048
            14  C8x C    29.4254  -20.5095
            15  C8x C    28.2197  -18.4069
            16  C8x C    30.6427  -19.8165
            17  C8x C    29.4370  -17.7080
            18  C8y C    30.6485  -18.4186
            19  O1a O    31.8658  -17.7196
BOND        21
            1     4   8 2
            2     4   9 1
            3     5  10 1
            4     6  11 2
            5     8  12 1
            6     7  10 1
            7     8  11 1
            8     7  13 1 #Down
            9     1   2 2
            10    1   3 1
            11    1   4 1
            12    2   5 1
            13    2   6 1
            14    3   7 1
            15   13  14 2
            16   13  15 1
            17   14  16 1
            18   15  17 2
            19   16  18 2
            20   18  19 1
            21   17  18 1

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