KEGG   COMPOUND: C15031
Entry
C15031                      Compound                               

Name
2-(4-Hydroxyphenyl)-5,6,7,8-tetrahydroxy-4H-1-benzopyran-4-one;
5,6,7,8,4'-Pentahydroxyflavone;
Nortangeretin
Formula
C15H10O7
Exact mass
302.0427
Mol weight
302.2357
Structure
Other DBs
CAS: 577-26-4
PubChem: 17396028
ChEBI: 79553
ChEMBL: CHEMBL234338
NIKKAJI: J1.571.587A
KCF data

ATOM        22
            1   C8y C    20.3308  -15.8646
            2   C8y C    20.3308  -17.2618
            3   C8y C    21.5409  -17.9605
            4   C8x C    22.7513  -17.2618
            5   C8y C    22.7513  -15.8646
            6   O2x O    21.5409  -15.1658
            7   C8y C    19.1206  -15.1658
            8   C8y C    17.9102  -15.8646
            9   C8y C    17.9102  -17.2618
            10  C8y C    19.1206  -17.9605
            11  C8y C    23.9800  -15.1547
            12  C8x C    25.1829  -15.8493
            13  C8x C    26.3930  -15.1503
            14  C8y C    26.3930  -13.7528
            15  C8x C    25.1901  -13.0585
            16  C8x C    23.9799  -13.7572
            17  O1a O    27.6088  -13.0508
            18  O1a O    16.6813  -15.1547
            19  O1a O    16.6813  -17.9716
            20  O1a O    19.1206  -19.3579
            21  O5x O    21.5408  -19.3789
            22  O1a O    19.1204  -13.7824
BOND        24
            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   14  17 1
            20    8  18 1
            21    9  19 1
            22   10  20 1
            23    3  21 2
            24    7  22 1

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