KEGG   COMPOUND: C09479Help
Entry
C09479                      Compound                               

Name
Betagarin;
5,2'-Dimethoxy-6,7-methylenedioxyflavanone
Formula
C18H16O6
Exact mass
328.0947
Mol weight
328.316
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1214 Flavanones
    C09479  Betagarin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavanones
    C09479  Betagarin
BRITE hierarchy
Other DBs
CAS: 60132-69-6
PubChem: 11670
ChEBI: 27679
KNApSAcK: C00000942
3DMET: B03006
NIKKAJI: J17.981G
KCF data Show

ATOM        24
            1   C8y C    23.1697  -15.9601
            2   C8y C    21.9776  -16.6608
            3   C8y C    23.1756  -14.5632
            4   C5x C    24.3795  -16.6667
            5   C8y C    20.7621  -15.9601
            6   O2a O    21.9776  -18.0635
            7   O2x O    24.3912  -13.8670
            8   C8x C    21.9776  -13.8612
            9   C1x C    25.5948  -15.9719
            10  O5x O    24.3736  -18.0635
            11  C8y C    20.7621  -14.5572
            12  O2x O    19.4237  -16.3917
            13  C1a C    20.7681  -18.7712
            14  C1y C    25.6008  -14.5749
            15  O2x O    19.4296  -14.1245
            16  C1x C    18.5989  -15.2522
            17  C8y C    26.8164  -13.8814
            18  C8y C    28.0201  -14.5924
            19  C8x C    26.8162  -12.4820
            20  C8x C    29.2427  -13.8904
            21  O2a O    28.0142  -15.9953
            22  C8x C    28.0318  -11.7872
            23  C8x C    29.2485  -12.4938
            24  C1a C    29.2251  -16.6901
BOND        27
            1     4   9 1
            2     4  10 2
            3     5  11 1
            4     5  12 1
            5     6  13 1
            6     7  14 1
            7    11  15 1
            8    12  16 1
            9     8  11 2
            10    9  14 1
            11   15  16 1
            12   14  17 1 #Down
            13    1   2 1
            14    1   3 2
            15    1   4 1
            16    2   5 2
            17    2   6 1
            18    3   7 1
            19    3   8 1
            20   17  18 2
            21   17  19 1
            22   18  20 1
            23   18  21 1
            24   19  22 2
            25   20  23 2
            26   21  24 1
            27   22  23 1

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