KEGG   COMPOUND: C14997Help
Entry
C14997                      Compound                               

Name
2,3-Dihydro-6-hydroxy-2-(4-methoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one;
6-Hydroxy-4',5,7-trimethoxyflavanone
Formula
C18H18O6
Exact mass
330.1103
Mol weight
330.3319
Structure
Mol fileKCF fileDB search
Other DBs
CAS: 6626-61-5
PubChem: 17395994
ChEBI: 79520
ChEMBL: CHEMBL450307
NIKKAJI: J948.997E
LinkDB All DBs
KCF data Show

ATOM        24
            1   C8y C    20.3225  -15.5084
            2   C8y C    20.3225  -16.9052
            3   C5x C    21.5321  -17.6036
            4   C1x C    22.7420  -16.9052
            5   C1y C    22.7420  -15.5084
            6   O2x O    21.5321  -14.8099
            7   C8x C    19.1128  -14.8099
            8   C8y C    17.9029  -15.5084
            9   C8y C    17.9029  -16.9052
            10  C8y C    19.1128  -17.6036
            11  C8y C    23.9703  -14.7988
            12  C8x C    25.1727  -15.4932
            13  C8x C    26.3823  -14.7944
            14  C8y C    26.3823  -13.3975
            15  C8x C    25.1799  -12.7035
            16  C8x C    23.9702  -13.4019
            17  O2a O    27.5977  -12.6958
            18  O5x O    21.5321  -19.0004
            19  O2a O    16.6745  -14.7988
            20  O1a O    16.6745  -17.6147
            21  O2a O    19.1128  -19.0004
            22  C1a C    17.9198  -19.6893
            23  C1a C    16.6748  -13.4130
            24  C1a C    28.8413  -13.4133
BOND        26
            1     1   2 2
            2     2   3 1
            3     3   4 1
            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    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   14  17 1
            20    3  18 2
            21    8  19 1
            22    9  20 1
            23   10  21 1
            24   21  22 1
            25   19  23 1
            26   17  24 1

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