KEGG   COMPOUND: C09636Help
Entry
C09636                      Compound                               

Name
Diffutin
Formula
C23H28O10
Exact mass
464.1682
Mol weight
464.4624
Structure
Mol fileKCF fileDB search
Brite
Lipids [BR:br08002]
 PK  Polyketides
  PK12 Flavonoids
   PK1202 Flavans, Flavanols and Leucoanthocyanidins
    C09636  Diffutin
Phytochemical compounds [BR:br08003]
 Flavonoids
  Flavonoids
   Flavans
    C09636  Diffutin
BRITE hierarchy
Other DBs
CAS: 89289-91-8
PubChem: 11826
ChEBI: 4536
KNApSAcK: C00008768
3DMET: B03150
NIKKAJI: J146.600C
KCF data Show

ATOM        33
            1   C1y C    28.3253  -18.7077
            2   C8y C    29.5325  -18.0107
            3   C8y C    25.9131  -18.6960
            4   C8y C    25.9074  -20.0944
            5   O2x O    27.1251  -18.0085
            6   C8x C    24.7070  -18.0027
            7   C8y C    24.7070  -20.7876
            8   C1x C    27.1075  -20.7935
            9   C8y C    23.5010  -18.6960
            10  O2a O    24.7130  -22.1802
            11  C8x C    23.5010  -20.0944
            12  C1x C    28.3195  -20.1001
            13  O1a O    22.2949  -18.0027
            14  C1y C    23.3029  -22.9958
            15  O2x O    22.0969  -22.2968
            16  C1y C    23.3029  -24.3884
            17  C1y C    20.8851  -22.9958
            18  C1y C    22.0969  -25.0817
            19  O1a O    24.5090  -25.0817
            20  C1y C    20.8851  -24.3884
            21  C1b C    19.6790  -22.2968
            22  O1a O    22.0969  -26.4801
            23  O1a O    19.6790  -25.0876
            24  O1a O    18.4729  -22.9901
            25  C8x C    29.5373  -16.6277
            26  C8x C    30.7374  -18.7252
            27  C8y C    30.7491  -15.9343
            28  C8x C    32.0192  -18.0318
            29  C8y C    31.9552  -16.6393
            30  O2a O    30.7548  -14.5359
            31  O2a O    33.1612  -15.9459
            32  C1a C    31.9668  -13.8484
            33  C1a C    34.3673  -16.6451
BOND        36
            1     7  10 1
            2     7  11 2
            3     8  12 1
            4     9  13 1
            5    14  10 1 #Up
            6    14  15 1
            7    14  16 1
            8    15  17 1
            9    16  18 1
            10   16  19 1 #Down
            11   17  20 1
            12   17  21 1 #Up
            13   18  22 1 #Up
            14   20  23 1 #Down
            15   21  24 1
            16    1  12 1
            17    9  11 1
            18   18  20 1
            19    1   2 1 #Down
            20    3   4 2
            21    3   5 1
            22    3   6 1
            23    4   7 1
            24    4   8 1
            25    5   1 1
            26    6   9 2
            27    2  25 1
            28    2  26 2
            29   25  27 2
            30   26  28 1
            31   27  29 1
            32   27  30 1
            33   29  31 1
            34   30  32 1
            35   31  33 1
            36   28  29 2

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