KEGG   COMPOUND: C10877
Entry
C10877                      Compound                               
Name
Prostalidin A
Formula
C21H14O8
Exact mass
394.0689
Mol weight
394.3311
Structure
Brite
Phytochemical compounds [BR:br08003]
 Phenylpropanoids
  Lignans
   Lignans
    C10877  Prostalidin A
Other DBs
CAS: 73461-17-3
PubChem: 13060
ChEBI: 8522
KNApSAcK: C00000727
3DMET: B04181
NIKKAJI: J2.781.935D
LinkDB
KCF data

ATOM        29
            1   C8x C    23.3320  -22.7312
            2   C8y C    23.3320  -19.9314
            3   C8y C    24.5402  -20.6313
            4   C8y C    24.6042  -22.0312
            5   C8y C    25.7436  -22.7363
            6   C8x C    25.7556  -19.9365
            7   C8y C    26.9650  -20.6417
            8   C8y C    26.9623  -22.0456
            9   C1x C    28.2968  -22.4821
            10  O7x O    29.1240  -21.3477
            11  C7x C    28.3011  -20.2102
            12  C8y C    22.1168  -22.0312
            13  C8y C    22.1234  -20.6357
            14  O2x O    20.7983  -20.1985
            15  C1x C    19.9730  -21.3235
            16  O2x O    20.7878  -22.4561
            17  C8y C    25.7349  -24.1362
            18  C8y C    24.5203  -24.8207
            19  C8x C    24.5117  -26.2205
            20  C8x C    26.9449  -24.8358
            21  C8y C    26.9363  -26.2355
            22  C8y C    25.7212  -26.9376
            23  O2x O    26.0134  -28.3104
            24  C1x C    27.4092  -28.4563
            25  O2x O    27.9795  -27.1742
            26  O6a O    28.7361  -18.8797
            27  O2a O    23.3302  -18.5315
            28  C1a C    24.5417  -17.8298
            29  O1a O    23.3139  -24.1109
BOND        34
            1     7   6 2
            2     6   3 1
            3    12  13 1
            4    13  14 1
            5    14  15 1
            6    15  16 1
            7    16  12 1
            8     2  13 2
            9     5  17 1
            10   12   1 2
            11    1   4 1
            12   17  18 1
            13   18  19 2
            14   19  22 1
            15   21  20 1
            16   20  17 2
            17    3   2 1
            18    7   8 1
            19    8   9 1
            20    9  10 1
            21   10  11 1
            22   21  22 2
            23   22  23 1
            24   23  24 1
            25   24  25 1
            26   25  21 1
            27   11   7 1
            28   11  26 2
            29    3   4 2
            30    2  27 1
            31    4   5 1
            32   27  28 1
            33    5   8 2
            34   18  29 1

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