KEGG   COMPOUND: C15027
Entry
C15027                      Compound                               
Name
2,2-Dimethyl-3,4-bis(4-methoxyphenyl)-2H-1-benzopyran-7-ol acetate
Formula
C27H26O5
Exact mass
430.178
Mol weight
430.4923
Structure
Other DBs
PubChem: 17396024
ChEBI: 79549
NIKKAJI: J2.791.705D
LinkDB
KCF data

ATOM        32
            1   C8y C    21.6111  -13.0799
            2   C8y C    21.6111  -14.4786
            3   C2y C    22.8224  -15.1781
            4   C2y C    24.0340  -14.4786
            5   C1z C    24.0340  -13.0799
            6   O2x O    22.8224  -12.3804
            7   C8x C    20.3997  -12.3804
            8   C8y C    19.1881  -13.0799
            9   C8x C    19.1881  -14.4786
            10  C8x C    20.3997  -15.1781
            11  O7a O    17.9848  -12.3853
            12  C8y C    25.2478  -15.1795
            13  C8y C    22.8222  -16.6011
            14  C8x C    21.6164  -17.2969
            15  C8x C    21.6162  -18.6977
            16  C8y C    22.8293  -19.3983
            17  C8x C    24.0350  -18.7024
            18  C8x C    24.0352  -17.3016
            19  C8x C    25.2483  -16.6007
            20  C8x C    26.4617  -17.3007
            21  C8y C    27.6747  -16.5998
            22  C8x C    27.6742  -15.1787
            23  C8x C    26.4607  -14.4786
            24  O2a O    22.8291  -20.8035
            25  O2a O    28.8814  -17.2960
            26  C1a C    24.8168  -11.9370
            27  C1a C    25.2471  -13.7803
            28  C7a C    16.7771  -13.0828
            29  C1a C    15.5946  -12.4003
            30  O6a O    16.7769  -14.4995
            31  C1a C    30.1175  -16.5816
            32  C1a C    24.0288  -21.4963
BOND        35
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            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    8  11 1
            13    4  12 1
            14    3  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   13  18 1
            21   12  19 2
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   22  23 2
            26   12  23 1
            27   16  24 1
            28   21  25 1
            29    5  26 1
            30    5  27 1
            31   11  28 1
            32   28  29 1
            33   28  30 2
            34   25  31 1
            35   24  32 1

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