KEGG   COMPOUND: C14943Help
Entry
C14943                      Compound                               

Name
2-(2,5-Dimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
Formula
C21H22O8
Exact mass
402.1315
Mol weight
402.3946
Structure
Mol fileKCF fileDB searchJmolKegDraw
Other DBs
CAS: 
70460-30-9
PubChem: 
ChEBI: 
ChEMBL: 
NIKKAJI: 
LinkDB All DBs
KCF data Show

ATOM        29
            1   C8y C    20.9169  -16.1646
            2   C8y C    20.9169  -17.5638
            3   C8y C    22.1286  -18.2634
            4   C8x C    23.3405  -17.5638
            5   C8y C    23.3405  -16.1646
            6   O2x O    22.1286  -15.4650
            7   C8y C    19.7052  -15.4650
            8   C8y C    18.4933  -16.1646
            9   C8y C    18.4933  -17.5638
            10  C8y C    19.7052  -18.2634
            11  C8y C    24.5709  -15.4540
            12  C8x C    25.7753  -16.1493
            13  C8y C    26.9870  -15.4496
            14  C8x C    26.9870  -14.0504
            15  C8x C    25.7825  -13.3551
            16  C8y C    24.5708  -14.0548
            17  O5x O    22.1286  -19.6625
            18  O2a O    19.7052  -14.0660
            19  O2a O    17.2629  -15.4540
            20  O2a O    17.2629  -18.2745
            21  O2a O    19.7052  -19.6625
            22  C1a C    20.9338  -13.3566
            23  C1a C    16.0584  -17.5791
            24  C1a C    18.5103  -20.3525
            25  C1a C    17.2632  -14.0659
            26  O2a O    28.1890  -16.1438
            27  O2a O    23.3718  -13.3629
            28  C1a C    23.3716  -11.9776
            29  C1a C    28.1881  -17.5790
BOND        31
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 2
            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    5  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   11  16 1
            19    3  17 2
            20    7  18 1
            21    8  19 1
            22    9  20 1
            23   10  21 1
            24   18  22 1
            25   20  23 1
            26   21  24 1
            27   19  25 1
            28   13  26 1
            29   16  27 1
            30   27  28 1
            31   26  29 1

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